SCHEMBL19852034

SCHEMBL19852034

OC(COc1ccccc1)CN1CCN(c2cccc(Cl)c2)CC1

nearest known ligand 0.87

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.87
HTR7 P34969 4/20 0.77
KMT2A Q03164 2/20 0.74
MAPT P10636 9/20 0.73
TP53 P04637 1/20 0.73
MEN1 O00255 1/20 0.72
MAPK1 P28482 3/20 0.71
NLRP3 Q96P20 1/20 0.71
ALDH1A1 P00352 2/20 0.70
LMNA P02545 2/20 0.70
NPSR1 Q6W5P4 1/20 0.70
L3MBTL1 Q9Y468 2/20 0.65
CACNA1G O43497 1/20 0.64
TDP1 Q9NUW8 1/20 0.62

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
SCHEMBL30001848 1.00 RECQL (0.87) RECQLHTR7KMT2AMAPTTP53
SCHEMBL2020406 0.91 RECQL (0.87) RECQLHTR7KMT2AMAPTTP53
SCHEMBL2020403 0.91 RECQL (0.87) RECQLHTR7KMT2AMAPTTP53
SCHEMBL2020404 0.91 RECQL (0.87) RECQLHTR7KMT2AMAPTTP53
SCHEMBL23269343 0.90 RECQL (0.85) RECQLHTR7KMT2AMAPTTP53
SCHEMBL10485817 0.88 RECQL (0.69) RECQLHTR7KMT2AMAPTTP53
SCHEMBL11076689 0.88 RECQL (0.82) RECQLHTR7KMT2AMAPTTP53
SCHEMBL8613867 0.87 MAPT (0.82) HTR7KMT2AMAPTMEN1MAPK1
SCHEMBL20553410 0.87 MAPT (0.89) RECQLKMT2AMAPTTP53MEN1
SCHEMBL11076692 0.85 RECQL (0.77) RECQLHTR7KMT2AMAPTTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11186564-B2 Dual NAV1.2/5HT2a inhibitors for treating CNS disorders SUNOVION PHARMACEUTICALS INC. (US) 2021-11-30 US disclosed
US-11186564-B2 Dual NAV1.2/5HT2a inhibitors for treating CNS disorders SUNOVION PHARMACEUTICALS INC. (US) 2021-11-30 US disclosed
US-20200261442-A1 TARGETED DRUG RESCUE WITH NOVEL COMPOSITIONS, COMBINATIONS, AND METHODS THEREOF VEPACHEDU SREENIVASARAO (US) 2020-08-20 US disclosed
EP-3618819-A1 TARGETED DRUG RESCUE WITH NOVEL COMPOSITIONS, COMBINATIONS, AND METHODS THEREOF Exciva GmbH (DE) 2020-03-11 EP disclosed
US-20200069674-A1 TARGETED DRUG RESCUE WITH NOVEL COMPOSITIONS, COMBINATIONS, AND METHODS THEREOF Exciva GmbH (DE) 2020-03-05 US disclosed
US-20190194163-A1 DUAL NAV1.2/5HT2a INHIBITORS FOR TREATING CNS DISORDERS SUNOVION PHARMACEUTICALS INC. (US) 2019-06-27 US disclosed
US-20190194163-A1 DUAL NAV1.2/5HT2a INHIBITORS FOR TREATING CNS DISORDERS SUNOVION PHARMACEUTICALS INC. (US) 2019-06-27 US disclosed
WO-2018204713-A1 TARGETED DRUG RESCUE WITH NOVEL COMPOSITIONS, COMBINATIONS, AND METHODS THEREOF EXCIVA UG (HAFTUNGSBESCHRÄNKT) (DE) 2018-11-08 WO disclosed
WO-2018026371-A1 DUAL NAV1.2/5HT2A INHIBITORS FOR TREATING CNS DISORDERS SUNOVION PHARMACEUTICALS INC. (US) 2018-02-08 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 (4 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-20200069674-A1 TARGETED DRUG RESCUE WITH NOVEL COMPOSITIONS, COMBINATIONS, AND METHODS THEREOF HTR2A, HTR2C, CYP3A43 RECQL 438/4885HTR7 49/4885KMT2A 1669/4885
US-20190194163-A1 DUAL NAV1.2/5HT2a INHIBITORS FOR TREATING CNS DISORDERS SCN2A, HTR2A, HTR2C RECQL 1297/4885HTR7 112/4885KMT2A 572/4885
US-11186564-B2 Dual NAV1.2/5HT2a inhibitors for treating CNS disorders SCN2A, HTR2A, HTR2C RECQL 1297/4885HTR7 112/4885KMT2A 572/4885
US-20200261442-A1 TARGETED DRUG RESCUE WITH NOVEL COMPOSITIONS, COMBINATIONS, AND METHODS THEREOF HTR2C, HTR2A, HTR3A RECQL 644/4885HTR7 27/4885KMT2A 572/4885

“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.