SCHEMBL173735

SCHEMBL173735

Cn1ccc2cc(NC(=O)Nc3cccnc3)ccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 1.00
MEN1 O00255 6/20 1.00
KMT2A Q03164 6/20 1.00
HTR2B P41595 4/20 1.00
TP53 P04637 4/20 1.00
CYP1A2 P05177 4/20 1.00
CYP3A4 P08684 4/20 1.00
CYP2D6 P10635 4/20 1.00
CYP2C19 P33261 2/20 1.00
RECQL P46063 2/20 1.00
KDM4E B2RXH2 2/20 1.00
TDP1 Q9NUW8 2/20 1.00
HTR2C P28335 6/20 0.98
NPC1 O15118 7/20 0.58
RAB9A P51151 7/20 0.58
PKM P14618 3/20 0.58
THPO P40225 3/20 0.58
HIF1A Q16665 3/20 0.58
BLM P54132 3/20 0.58
SMN1; SMN2 Q16637 3/20 0.58

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29391435 1.00 MAPT (1.00) MAPTMEN1KMT2AHTR2BTP53
SCHEMBL29729330 1.00 MAPT (1.00) MAPTMEN1KMT2AHTR2BTP53
Hydrochloric Acid SCHEMBL31077673 0.99 HTR2C (1.00) MAPTMEN1KMT2AHTR2BTP53
Hydrochloric Acid SCHEMBL2116886 0.99 HTR2C (1.00) MAPTMEN1KMT2AHTR2BTP53
SCHEMBL9400617 0.90 MEN1 (0.82) MAPTMEN1KMT2AHTR2BTP53
Hydrochloric Acid SCHEMBL9400545 0.89 HTR2C (0.82) MAPTMEN1KMT2AHTR2BTP53
SCHEMBL8944943 0.86 HTR2B (0.75) MAPTMEN1KMT2AHTR2BTP53
SCHEMBL8944979 0.85 HTR2B (0.74) MAPTMEN1KMT2AHTR2BTP53
SCHEMBL9082294 0.85 HTR2B (0.73) MAPTMEN1KMT2AHTR2BTP53
SCHEMBL9400583 0.85 MEN1 (0.73) MAPTMEN1KMT2AHTR2BTP53

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 84 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220193082-A1 COMBINATION TREATMENT OF SPECIFIC FORMS OF EPILEPSY ZOGENIX INTERNATIONAL LIMITED (GB) 2022-06-23 US claimed
US-20180325909-A1 COMBINATION TREATMENT OF SPECIFIC FORMS OF EPILEPSY ZOGENIX INTERNATIONAL LIMITED (GB) 2018-11-15 US claimed
US-20170071949-A1 COMBINATION TREATMENT OF SPECIFIC FORMS OF EPILEPSY ZOGENIX INTERNATIONAL LIMITED (GB) 2017-03-16 US claimed
US-20050080084-A1 Compositions of a cyclooxygenase-2 selective inhibitor and a serotonin-modulating agent for the treatment of central nervous system damage PHARMACIA CORPORATION 2005-04-14 US claimed
WO-2005018541-A2 COX-2 INHIBITOR AND SEROTONIN MODULATOR FOR TREATING CNS DAMAGE PHARMACIA CORPORATION (US) 2005-03-03 WO claimed
EP-0936924-A2 PHARMACEUTICAL COMPOSITION CONTAINING A 5HT 2C? ANTAGONIST AND A D 2? ANTAGONIST SMITHKLINE BEECHAM PLC (GB) 1999-08-25 EP claimed
WO-1998004289-A2 PHARMACEUTICAL COMPOSITION CONTAINING A 5HT2C ANTAGONIST AND A D2 ANTAGONIST SMITHKLINE BEECHAM PLC (GB) 1998-02-05 WO claimed
US-5328922-A Anxiolytic and antidepressant activity BEECHAM GROUP P.L.C. (GB) 1994-07-12 US claimed
WO-1993018026-A1 INDOLE UREAS AS 5-HT1C RECEPTOR ANTOGONISTS BEECHAM GROUP PLC (GB) 1993-09-16 WO claimed
WO-1993016694-A1 USE OF INDYLPYRIDYLUREAS TO HEAL THE EFFECTS OF BRAIN OR SPIRAL TRAUMA SMITHKLINE BEECHAM PLC (GB) 1993-09-02 WO claimed
EP-0550507-A1 INDOLE UREAS AS 5 HT RECEPTOR ANTAGONIST Beecham Group p.l.c. (GB) 1993-07-14 EP claimed
WO-1992005170-A1 INDOLE UREAS AS 5 HT RECEPTOR ANTAGONIST BEECHAM GROUP PLC (GB) 1992-04-02 WO claimed
US-12533425-B2 Methods and systems using peptides for targeting and mapping human nerves in image guided surgery, diagnostics and therapeutic delivery ALUME BIOSCIENCES, INC. (US) 2026-01-27 US disclosed
EP-4484952-A2 OPTIMIZED PEPTIDES FOR TARGETING HUMAN NERVES AND THEIR USE IN IMAGE GUIDED SURGERY, DIAGNOSTICS AND THERAPEUTIC DELIVERY The Regents of the University of California (US) 2025-01-01 EP disclosed
EP-3661539-B1 OPTIMIZED PEPTIDES FOR TARGETING HUMAN NERVES AND THEIR USE IN IMAGE GUIDED SURGERY, DIAGNOSTICS AND THERAPEUTIC DELIVERY UNIV CALIFORNIA (US) 2024-10-09 EP disclosed
US-20240245693-A1 COMPOSITIONS AND METHODS OF TISSUE REGENERATION THERAPY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2024-07-25 US disclosed
EP-0936924-A2 PHARMACEUTICAL COMPOSITION CONTAINING A 5HT 2C? ANTAGONIST AND A D 2? ANTAGONIST SMITHKLINE BEECHAM PLC (GB) 1999-08-25 EP disclosed
WO-1998004289-A2 PHARMACEUTICAL COMPOSITION CONTAINING A 5HT2C ANTAGONIST AND A D2 ANTAGONIST SMITHKLINE BEECHAM PLC (GB) 1998-02-05 WO disclosed
WO-1996039382-A1 UREA DERIVATIVES AS 5-HT ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-12-12 WO disclosed
WO-1993016694-A1 USE OF INDYLPYRIDYLUREAS TO HEAL THE EFFECTS OF BRAIN OR SPIRAL TRAUMA SMITHKLINE BEECHAM PLC (GB) 1993-09-02 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12533425-B2 Methods and systems using peptides for targeting and mapping human nerves in image guided surgery, diagnostics and therapeutic delivery NGLY1, VGF, GAP43 MAPT 832/4885MEN1 1105/4885KMT2A 4260/4885
US-20220193082-A1 COMBINATION TREATMENT OF SPECIFIC FORMS OF EPILEPSY HTR2B, HTR3B, HTR5A MAPT 714/4885MEN1 919/4885KMT2A 726/4885
US-20050080084-A1 Compositions of a cyclooxygenase-2 selective inhibitor and a serotonin-modulating agent for the treatment of central nervous system damage TPH2, TPH1, HTR2A MAPT 1403/4885MEN1 3935/4885KMT2A 4040/4885
US-20180325909-A1 COMBINATION TREATMENT OF SPECIFIC FORMS OF EPILEPSY HTR2B, HTR3B, HTR5A MAPT 714/4885MEN1 919/4885KMT2A 726/4885
US-20240245693-A1 COMPOSITIONS AND METHODS OF TISSUE REGENERATION THERAPY ADORA2B, ADORA2A, ANXA3 MAPT 4790/4885MEN1 4509/4885KMT2A 1431/4885
US-20170071949-A1 COMBINATION TREATMENT OF SPECIFIC FORMS OF EPILEPSY HTR2B, HTR3B, HTR5A MAPT 714/4885MEN1 919/4885KMT2A 726/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.