SCHEMBL2619355

SCHEMBL2619355

CCCc1ccc(NC(=O)CC)cn1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 8/20 0.52
RAB9A P51151 5/20 0.52
MAPT P10636 4/20 0.52
NPC1 O15118 4/20 0.52
HSD17B10 Q99714 2/20 0.51
MAPK1 P28482 2/20 0.47
TP53 P04637 2/20 0.47
GAA P10253 2/20 0.46
ATM Q13315 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
CYP3A4 P08684 1/20 0.45
TSHR P16473 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
ALDH1A1 P00352 2/20 0.44
HPGD P15428 1/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44

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
SCHEMBL10272564 0.92 SMN1; SMN2 (0.56) SMN1; SMN2RAB9AMAPTNPC1HSD17B10
SCHEMBL2619354 0.87 SMN1; SMN2 (0.55) SMN1; SMN2RAB9AMAPTNPC1HSD17B10
SCHEMBL4550165 0.85 KMT2A (0.47) SMN1; SMN2RAB9AMAPTNPC1L3MBTL1
SCHEMBL10272562 0.83 L3MBTL1 (0.55) SMN1; SMN2RAB9AMAPTNPC1TP53
SCHEMBL28247995 0.81 SMN1; SMN2 (0.50) SMN1; SMN2RAB9AMAPTNPC1HSD17B10
SCHEMBL8792557 0.78 HSD17B10 (0.76) SMN1; SMN2RAB9AMAPTNPC1HSD17B10
SCHEMBL19151154 0.78 SMN1; SMN2 (0.56) SMN1; SMN2RAB9AMAPTNPC1HSD17B10
SCHEMBL22540339 0.77 SMN1; SMN2 (0.57) SMN1; SMN2RAB9AMAPTNPC1HSD17B10
SCHEMBL23845461 0.77 SMN1; SMN2 (0.55) SMN1; SMN2RAB9AMAPTNPC1HSD17B10
SCHEMBL12182424 0.77 ALDH1A1 (0.57) SMN1; SMN2RAB9AMAPTNPC1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022235715-A1 COMPOUNDS FOR INHIBITING OR DEGRADING ITK, COMPOSITIONS, COMPRISING THE SAME METHODS OF THEIR MAKING AND METHODS OF THEIR USE NURIX THERAPEUTICS, INC. (US) 2022-11-10 WO disclosed
US-20120165316-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-06-28 US disclosed
US-20120094997-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-04-19 US disclosed
US-20110251184-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-10-13 US disclosed
US-20110213003-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-09-01 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 (4 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-20120094997-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, HDAC5 SMN1; SMN2 848/4885RAB9A 1243/4885MAPT 2988/4885
US-20120165316-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC5, HDAC1 SMN1; SMN2 772/4885RAB9A 2543/4885MAPT 2108/4885
US-20110251184-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, H1-3 SMN1; SMN2 401/4885RAB9A 1951/4885MAPT 2395/4885
US-20110213003-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, HDAC3 SMN1; SMN2 852/4885RAB9A 2603/4885MAPT 2775/4885

“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.