SCHEMBL378363

SCHEMBL378363

Cc1cc(C=O)cc(C)c1OCCCO

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.50
ALDH1A1 P00352 5/20 0.41
KDM4E B2RXH2 2/20 0.41
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
TUBB1 Q9H4B7 1/20 0.37
HTR1A P08908 1/20 0.37
S1PR1 P21453 3/20 0.36
S1PR3 Q99500 3/20 0.36
THRA P10827 1/20 0.36
THRB P10828 1/20 0.36
MAPK1 P28482 2/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
ALOX12 P18054 1/20 0.36
RECQL P46063 1/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL145729 0.95 SRC (0.49) SRCALDH1A1KDM4EMEN1KMT2A
SCHEMBL147201 0.91 SRC (0.51) SRCALDH1A1KDM4EMEN1KMT2A
SCHEMBL8612271 0.87 SRC (0.50) SRCALDH1A1KDM4EMEN1KMT2A
SCHEMBL5351709 0.87 SRC (0.53) SRCALDH1A1KDM4EMEN1KMT2A
SCHEMBL5144244 0.84 SRC (0.47) SRCALDH1A1KDM4EMEN1KMT2A
SCHEMBL27898705 0.83 KDM4E (0.36) SRCALDH1A1KDM4EMEN1KMT2A
SCHEMBL7679676 0.82 SRC (0.46) SRCALDH1A1KDM4EMEN1KMT2A
SCHEMBL8035224 0.81 THRA (0.51) SRCALDH1A1KDM4EMEN1KMT2A
SCHEMBL7164671 0.80 TSHR (0.45) SRCALDH1A1KDM4EMEN1KMT2A
SCHEMBL2651217 0.80 SRC (0.47) SRCALDH1A1KDM4EMEN1KMT2A

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2408454-B1 NOVEL ANTI-INFLAMMATORY AGENTS RESVERLOGIX CORP (CA) 2024-07-24 EP disclosed
US-11407719-B2 Anti-inflammatory agents RESVERLOGIX CORP. (CA) 2022-08-09 US disclosed
US-20210070716-A1 ANTI-INFLAMMATORY AGENTS HEPALINK (HONG KONG) LIMITED (HK) 2021-03-11 US disclosed
US-10882828-B2 Anti-inflammatory agents RESVERLOGIX CORP. (CA) 2021-01-05 US disclosed
US-20190119222-A1 NOVEL ANTI-INFLAMMATORY AGENTS RESVERLOGIX CORP. (CA) 2019-04-25 US disclosed
US-10131640-B2 Anti-inflammatory agents RESVERLOGIX CORP. (CA) 2018-11-20 US disclosed
US-20160137613-A1 NOVEL ANTI-INFLAMMATORY AGENTS RESVERLOGIX CORP. (CA) 2016-05-19 US disclosed
US-9238640-B2 Anti-inflammatory agents RESVERLOGIX CORP. (CA) 2016-01-19 US disclosed
WO-2013175281-A1 USE OF SUBSTITUTED 2-PHENYL-3H-QUINAZOLIN-4-ONES AND ANALOGS FOR INHIBITING BROMODOMAIN AND EXTRA TERMINAL DOMAIN (BET) PROTEINS RVX THERAPEUTICS INC. (CA) 2013-11-28 WO disclosed
US-20130281399-A1 TREATMENT OF DISEASES BY EPIGENETIC REGULATION RVX THERAPEUTICS INC. (CA) 2013-10-24 US disclosed
US-20120040954-A1 NOVEL ANTI-INFLAMMATORY AGENTS HEPALINK (HONG KONG) LIMITED (HK) 2012-02-16 US disclosed
EP-2408454-A2 NOVEL ANTI-INFLAMMATORY AGENTS RESVERLOGIX CORP. (CA) 2012-01-25 EP disclosed
WO-2010106436-A2 NOVEL ANTI-INFLAMMATORY AGENTS RESVERLOGIX CORP. (CA) 2010-09-23 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 (8 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-11407719-B2 Anti-inflammatory agents VCAM1, ICAM1, IL6 SRC 2560/4885ALDH1A1 587/4885KDM4E 3982/4885
US-20160137613-A1 NOVEL ANTI-INFLAMMATORY AGENTS VCAM1, ICAM1, IL6 SRC 2864/4885ALDH1A1 650/4885KDM4E 3726/4885
US-20130281399-A1 TREATMENT OF DISEASES BY EPIGENETIC REGULATION PHKB, BAZ2A, EP300 SRC 1051/4885ALDH1A1 3920/4885KDM4E 342/4885
US-10882828-B2 Anti-inflammatory agents VCAM1, ICAM1, IL6 SRC 2560/4885ALDH1A1 587/4885KDM4E 3982/4885
US-20210070716-A1 ANTI-INFLAMMATORY AGENTS VCAM1, ICAM1, IL6 SRC 2560/4885ALDH1A1 587/4885KDM4E 3982/4885
US-10131640-B2 Anti-inflammatory agents VCAM1, ICAM1, IL6 SRC 2560/4885ALDH1A1 587/4885KDM4E 3982/4885
US-20190119222-A1 NOVEL ANTI-INFLAMMATORY AGENTS VCAM1, ICAM1, IL6 SRC 2864/4885ALDH1A1 650/4885KDM4E 3726/4885
US-20120040954-A1 NOVEL ANTI-INFLAMMATORY AGENTS VCAM1, ICAM1, IL6 SRC 2864/4885ALDH1A1 650/4885KDM4E 3726/4885

“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.