SCHEMBL1944178

SCHEMBL1944178

Cc1c(Cl)cc([N+](=O)[O-])cc1N=C=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.47
HSD17B10 Q99714 1/20 0.41
GPR35 Q9HC97 2/20 0.40
TSHR P16473 2/20 0.40
CYP3A4 P08684 2/20 0.38
KMT2A Q03164 5/20 0.37
VCAM1 P19320 2/20 0.35
MEN1 O00255 4/20 0.34
NPC1 O15118 2/20 0.34
POLB P06746 1/20 0.34
RAB9A P51151 1/20 0.34
CYP19A1 P11511 1/20 0.34
TRPA1 O75762 1/20 0.34
GRIN2D O15399 1/20 0.34
GRIN3B O60391 1/20 0.34
GRIN1 Q05586 1/20 0.34
GRIN2A Q12879 1/20 0.34
GRIN2B Q13224 1/20 0.34
GRIN2C Q14957 1/20 0.34
GRIN3A Q8TCU5 1/20 0.34

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
SCHEMBL1944148 0.83 ALDH1A1 (0.43) ALDH1A1HSD17B10GPR35TSHRCYP3A4
SCHEMBL1751440 0.78 ALDH1A1 (0.67) ALDH1A1HSD17B10GPR35TSHRCYP3A4
SCHEMBL10531862 0.78 ALDH1A1 (0.55) ALDH1A1HSD17B10GPR35TSHRKMT2A
SCHEMBL1946782 0.77 ALDH1A1 (0.40) ALDH1A1TSHRCYP3A4KMT2AMEN1
SCHEMBL1940462 0.77 HSD17B10 (0.56) ALDH1A1HSD17B10TSHRCYP3A4KMT2A
SCHEMBL29471399 0.77 HSD17B10 (0.56) ALDH1A1HSD17B10TSHRKMT2AVCAM1
SCHEMBL1513945 0.77 HSD17B10 (0.56) ALDH1A1HSD17B10TSHRKMT2AVCAM1
SCHEMBL9643670 0.74 CYP3A4 (0.52) ALDH1A1TSHRCYP3A4TRPA1TDP1
SCHEMBL1944961 0.74 ALDH1A1 (0.41) ALDH1A1KMT2AMEN1POLBLMNA
SCHEMBL374389 0.73 ALDH1A1 (0.56) ALDH1A1HSD17B10TSHRCYP3A4KMT2A

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-9732070-B2 Protein kinase C inhibitors and uses thereof RIGEL PHARMACEUTICALS, INC. (US) 2017-08-15 US disclosed
US-9732070-B2 Protein kinase C inhibitors and uses thereof RIGEL PHARMACEUTICALS, INC. (US) 2017-08-15 US disclosed
US-9732070-B2 Protein kinase C inhibitors and uses thereof RIGEL PHARMACEUTICALS, INC. (US) 2017-08-15 US disclosed
US-20170152246-A1 Protein Kinase C Inhibitors and Uses Thereof MIDCAP FINANCIAL TRUST 2017-06-01 US disclosed
US-20170152246-A1 Protein Kinase C Inhibitors and Uses Thereof MIDCAP FINANCIAL TRUST 2017-06-01 US disclosed
US-20170152246-A1 Protein Kinase C Inhibitors and Uses Thereof MIDCAP FINANCIAL TRUST 2017-06-01 US disclosed
EP-2507227-B1 TETRAZOLONES AS PROTEIN KINASE C INHIBITORS AND USES THEREOF RIGEL PHARMACEUTICALS INC (US) 2014-10-08 EP disclosed
WO-2011068898-A1 PROTEIN KINASE C INHIBITORS AND USES THEREOF RIGEL PHARMACEUTICALS, INC. (US) 2011-06-09 WO disclosed
US-20110130415-A1 PROTEIN KINASE C INHIBITORS AND USES THEREOF RIGEL PHARMACEUTICALS, INC. 2011-06-02 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 (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-20110130415-A1 PROTEIN KINASE C INHIBITORS AND USES THEREOF PRKCH, PRKCA, PRKCB ALDH1A1 4361/4885HSD17B10 2599/4885GPR35 3912/4885
US-20170152246-A1 Protein Kinase C Inhibitors and Uses Thereof PRKCH, PRKCA, PRKCB ALDH1A1 4361/4885HSD17B10 2599/4885GPR35 3912/4885

“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.