SCHEMBL15676751

SCHEMBL15676751

CCc1cccc(C(=O)N(C)Cc2ccc(C)cc2)c1

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.66
MEN1 O00255 5/20 0.66
HSD17B1 P14061 3/20 0.52
HSD17B2 P37059 3/20 0.52
LIMK2 P53671 1/20 0.48
HSP90AA1 P07900 1/20 0.48
HDAC1 Q13547 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
ALDH1A1 P00352 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MEP1B Q16820 1/20 0.47
HPGD P15428 2/20 0.47
MMP13 P45452 1/20 0.47
GAA P10253 1/20 0.47
TSHR P16473 1/20 0.47

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
SCHEMBL15676710 0.90 KMT2A (0.82) KMT2AMEN1HSD17B1HSD17B2HDAC1
SCHEMBL10268085 0.89 KMT2A (0.62) KMT2AMEN1HSD17B1HSD17B2LIMK2
SCHEMBL15676756 0.87 KMT2A (0.65) KMT2AMEN1HSD17B1HSD17B2LIMK2
SCHEMBL15676750 0.87 KMT2A (0.64) KMT2AMEN1HSD17B1HSD17B2LIMK2
SCHEMBL18773850 0.87 KMT2A (0.67) KMT2AMEN1HSD17B1HSD17B2LIMK2
SCHEMBL1691687 0.85 KMT2A (0.61) KMT2AMEN1HSD17B1HSD17B2LIMK2
SCHEMBL15676804 0.85 KMT2A (0.82) KMT2AMEN1HSD17B2LIMK2HSP90AA1
SCHEMBL18970421 0.85 KMT2A (0.61) KMT2AMEN1HSD17B1HSD17B2LIMK2
SCHEMBL10268291 0.84 KMT2A (0.64) KMT2AMEN1HSD17B1HSD17B2ALDH1A1
SCHEMBL15676803 0.84 KMT2A (0.59) KMT2AMEN1HSD17B1HSD17B2HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170166560-A1 FIVE-MEMBERED HETEROCYCLES USEFUL AS SERINE PROTEASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2017-06-15 US disclosed
EP-1773786-B1 FIVE-MEMBERED HETEROCYCLES USEFUL AS SERINE PROTEASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2017-04-26 EP disclosed
US-9617224-B2 Five-membered heterocycles useful as serine protease inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2017-04-11 US disclosed
US-20150259297-A1 FIVE-MEMBERED HETEROCYCLES USEFUL AS SERINE PROTEASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2015-09-17 US disclosed
US-9079860-B2 Five-membered heterocycles useful as serine protease inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2015-07-14 US disclosed
US-8716492-B2 Five-membered heterocycles useful as serine protease inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2014-05-06 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-20170166560-A1 FIVE-MEMBERED HETEROCYCLES USEFUL AS SERINE PROTEASE INHIBITORS F12, F11, F5 KMT2A 2123/4885MEN1 1384/4885HSD17B1 1388/4885
US-20150259297-A1 FIVE-MEMBERED HETEROCYCLES USEFUL AS SERINE PROTEASE INHIBITORS F12, F11, F5 KMT2A 2123/4885MEN1 1384/4885HSD17B1 1388/4885

“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.