SCHEMBL14946402

SCHEMBL14946402

CC1Cc2ccccc2NC1C

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.47
MAPT P10636 1/20 0.47
BRD4 O60885 4/20 0.46
CREBBP Q92793 3/20 0.46
AR P10275 3/20 0.40
TSHR P16473 1/20 0.39
EP300 Q09472 1/20 0.39
OPRM1 P35372 1/20 0.37
EPHX2 P34913 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
SCHEMBL22383643 0.80 MTNR1A (0.43) GAAMAPTBRD4CREBBP
SCHEMBL16169476 0.80 GAA (0.49) GAAMAPTBRD4CREBBPAR
SCHEMBL33268 0.78 CREBBP (0.55) GAAMAPTBRD4CREBBPAR
SCHEMBL1736809 0.78 CREBBP (0.55) GAAMAPTBRD4CREBBPAR
SCHEMBL12837999 0.78 CREBBP (0.55) GAAMAPTBRD4CREBBPAR
SCHEMBL29572486 0.78 CREBBP (0.55) GAAMAPTBRD4CREBBPAR
SCHEMBL1868013 0.78 CREBBP (0.55) GAAMAPTBRD4CREBBPAR
SCHEMBL21172542 0.77 GAA (0.42) GAAMAPTBRD4CREBBPAR
SCHEMBL21172557 0.77 GAA (0.42) GAAMAPTBRD4CREBBPAR
SCHEMBL13306140 0.77 GAA (0.46) GAAMAPTBRD4CREBBPAR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9748044-B2 Photosensitizer and photoelectric conversion device CHEMICREA INC. (JP) 2017-08-29 US disclosed
US-20170092436-A1 PHOTOSENSITIZER AND PHOTOELECTRIC CONVERSION DEVICE CHEMICREA INC. (JP) 2017-03-30 US disclosed
US-8741924-B2 Compounds and methods for treatment of systemic lupus erythematosus THE FEINSTEIN INSTITUTE FOR MEDICAL RESEARCH (US) 2014-06-03 US disclosed
US-20130123299-A1 COMPOUNDS AND METHODS FOR TREATMENT OF SYSTEMIC LUPUS ERYTHEMATOSUS THE FEINSTEIN INSTITUTE FOR MEDICAL RESEARCH (US) 2013-05-16 US 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 (1 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-20130123299-A1 COMPOUNDS AND METHODS FOR TREATMENT OF SYSTEMIC LUPUS ERYTHEMATOSUS SSB, DNASE1L3, SNRPD2 GAA 1281/4885MAPT 4658/4885BRD4 247/4885

“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.