SCHEMBL17974952

SCHEMBL17974952

CCOC(=O)c1c[nH]c2c(=O)n(C)cc(Br)c12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLEC4M Q9H2X3 1/20 0.47
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C19 P33261 1/20 0.46
GABRA1 P14867 2/20 0.44
GABRB2 P47870 2/20 0.44
GABRB1 P18505 1/20 0.44
GABRA3 P34903 1/20 0.44
JAK3 P52333 3/20 0.44
BAZ2B Q9UIF8 1/20 0.44
BAZ2A Q9UIF9 1/20 0.44
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
KDM4E B2RXH2 4/20 0.42
NPSR1 Q6W5P4 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
MAPT P10636 2/20 0.41
ALDH1A1 P00352 2/20 0.41
JAK2 O60674 2/20 0.39
GAA P10253 1/20 0.39

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
SCHEMBL17974953 0.87 CLEC4M (0.48) CLEC4MCYP1A2CYP3A4CYP2C19GABRA1
SCHEMBL17974954 0.86 ALDH1A1 (0.42) CLEC4MCYP1A2CYP3A4CYP2C19JAK3
SCHEMBL17975182 0.80 CLEC4M (0.40) CLEC4MCYP1A2CYP3A4CYP2C19GABRA1
SCHEMBL17963325 0.78 ALDH1A1 (0.33) KMT2AALDH1A1
SCHEMBL23212216 0.77 GABRA1 (0.38) CLEC4MGABRA1GABRB2GABRB1GABRA3
SCHEMBL17963447 0.77 MAPT (0.45) CYP1A2CYP3A4CYP2C19MEN1KMT2A
SCHEMBL15956965 0.74 BRD4 (0.53) BAZ2BBAZ2AKMT2AKDM4ENPSR1
SCHEMBL31348908 0.74 KDM4E (0.56) CLEC4MCYP1A2CYP3A4CYP2C19GABRA1
SCHEMBL11895681 0.73 CLEC4M (0.53) CLEC4MCYP1A2CYP3A4CYP2C19GABRA1
SCHEMBL2035901 0.72 CLEC4M (0.55) CLEC4MCYP1A2CYP3A4CYP2C19GABRA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107531692-B Therapeutic compounds and uses thereof 基因泰克公司 2020-12-25 CN disclosed
US-10202378-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2019-02-12 US disclosed
WO-2016123391-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2016-08-04 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 (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-10202378-B2 Therapeutic compounds and uses thereof TAF1, TAF1L, TAF1B CLEC4M 4872/4885CYP1A2 3656/4885CYP3A4 4039/4885

“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.