SCHEMBL20465149

SCHEMBL20465149

Cc1ccc2c(c1)cc(C(C)O)n2C

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.47
▸ RXFP1 Q9HBX9 3/20 0.47
▸ THRB P10828 1/20 0.44
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ LMNA P02545 6/20 0.41
▸ TP53 P04637 4/20 0.41
▸ HTR2A P28223 1/20 0.38
▸ HTR2C P28335 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ GFER P55789 1/20 0.38
▸ ACSS2 Q9NR19 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP2A6 P11509 1/20 0.37

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
SCHEMBL26745662 0.85 RXFP1 (0.50) MAPTRXFP1THRBMEN1KMT2A
SCHEMBL31291305 0.78 MCL1 (0.53) MAPTMEN1KMT2AKDM4E
SCHEMBL11600616 0.78 MCL1 (0.53) MAPTMEN1KMT2AKDM4E
SCHEMBL29769204 0.72 MAPT (0.57) MAPTRXFP1THRBMEN1KMT2A
SCHEMBL5985980 0.72 MAPT (0.57) MAPTRXFP1THRBMEN1KMT2A
SCHEMBL5599830 0.71 KDM4E (0.68) MAPTRXFP1THRBMEN1KMT2A
SCHEMBL30547707 0.71 KDM4E (0.68) MAPTRXFP1THRBMEN1KMT2A
SCHEMBL28363847 0.70 THRB (0.41) MAPTRXFP1THRBMEN1KMT2A
SCHEMBL13677550 0.70 MAPT (0.46) MAPTRXFP1MEN1KMT2ALMNA
SCHEMBL13365035 0.70 KMT2A (0.39) MAPTRXFP1THRBMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180222860-A1 MODULATORS OF ROR-GAMMA VITAE PHARMACEUTICALS, LLC 2018-08-09 — — 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-20180222860-A1 MODULATORS OF ROR-GAMMA RORB, RORC, RORA MAPT 3698/4885RXFP1 154/4885THRB 55/4885

“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.

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