SCHEMBL6786259

SCHEMBL6786259

Cc1cc(C)cc(-c2cccc3c2[C@@H]2CCNCC[C@@H]2N3)c1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.41
CREBBP Q92793 1/20 0.41
HTR2C P28335 4/20 0.36
CHRM1 P11229 1/20 0.35
LMNA P02545 1/20 0.35
TSHR P16473 1/20 0.35
GABRA1 P14867 1/20 0.32
GABRB2 P47870 1/20 0.32

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
SCHEMBL6786256 1.00 BRD4 (0.41) BRD4CREBBPHTR2CCHRM1LMNA
SCHEMBL6790502 0.91 HTR2C (0.41) HTR2CCHRM1LMNATSHRGABRA1
SCHEMBL6790499 0.91 HTR2C (0.41) HTR2CCHRM1LMNATSHRGABRA1
SCHEMBL6792806 0.90 BRD4 (0.34) BRD4CREBBPHTR2CCHRM1LMNA
SCHEMBL6792807 0.90 BRD4 (0.34) BRD4CREBBPHTR2CCHRM1LMNA
SCHEMBL6786365 0.88 KDM1A (0.36) HTR2CLMNATSHRGABRA1GABRB2
SCHEMBL6786361 0.88 KDM1A (0.36) HTR2CLMNATSHRGABRA1GABRB2
SCHEMBL6786805 0.85 HTR7 (0.43) BRD4CREBBPHTR2CCHRM1LMNA
SCHEMBL6786809 0.85 HTR7 (0.43) BRD4CREBBPHTR2CCHRM1LMNA
SCHEMBL6786914 0.84 CHRM1 (0.37) CHRM1LMNATSHRGABRA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6828314-B2 Modulation of the activity of serotonin receptors (5-HT) to treat diseases such as anxiety, depression or obesity PFIZER 2004-12-07 US disclosed
US-20030225058-A1 Substituted azepino[4,5b]indoline derivatives PHARMACIA & UPJOHN COMPANY 2003-12-04 US disclosed
US-6586421-B2 For therapy of central nervous system, including diseases, disorders, and conditions related to, such as anxiety, depression, hypertension, migraine, obesity, compulsive disorders, schizophrenia, autism, neurodegenerative disorders PHARMACIA & UPJOHN COMPANY 2003-07-01 US disclosed
EP-1319005-A2 SUBSTITUTED AZEPINO[4,5-B]INDOLINE DERIVATIVES PHARMACIA & UPJOHN COMPANY (US) 2003-06-18 EP disclosed
US-20020077318-A1 Substituted azepino[4,5b] indoline derivatives PHARMACIA & UPJOHN COMPANY 2002-06-20 US disclosed
WO-2002024700-A2 SUBSTITUTED AZEPINO[4,5b]INDOLINE DERIVATIVES PHARMACIA & UPJOHN COMPANY (US) 2002-03-28 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 (2 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-20030225058-A1 Substituted azepino[4,5b]indoline derivatives HTR5A, HTR1A, HTR4 BRD4 1644/4885CREBBP 3464/4885HTR2C 6/4885
US-20020077318-A1 Substituted azepino[4,5b] indoline derivatives HTR5A, HTR1A, HTR4 BRD4 1644/4885CREBBP 3464/4885HTR2C 6/4885

“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.