SCHEMBL14060993

SCHEMBL14060993

CCCN(CCC)c1nn(-c2ccc(C(=O)O)cc2C(=O)OCC)c(C(F)(F)F)c1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 5/20 0.45
BCL2L1 Q07817 5/20 0.45
TRPC1 P48995 2/20 0.39
TRPC3 Q13507 2/20 0.39
STIM1 Q13586 2/20 0.39
ORAI1 Q96D31 2/20 0.39
STIM2 Q9P246 2/20 0.39
KDM4E B2RXH2 5/20 0.36
NPSR1 Q6W5P4 1/20 0.36
ALDH1A1 P00352 4/20 0.35
MAPT P10636 4/20 0.35
HPGD P15428 3/20 0.35
HSD17B10 Q99714 1/20 0.35
MEN1 O00255 2/20 0.35
GAA P10253 2/20 0.35
KMT2A Q03164 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
POLB P06746 1/20 0.34
CRHR1 P34998 1/20 0.33

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
SCHEMBL14149711 0.90 BCL2 (0.43) BCL2BCL2L1KDM4EALDH1A1MAPT
SCHEMBL14061142 0.89 BCL2 (0.45) BCL2BCL2L1KDM4EALDH1A1MAPT
SCHEMBL14061065 0.88 BCL2 (0.43) BCL2BCL2L1KDM4EALDH1A1MAPT
SCHEMBL15701757 0.86 TRPC1 (0.43) TRPC1TRPC3STIM1ORAI1STIM2
SCHEMBL14149529 0.77 BCL2 (0.42) BCL2BCL2L1ALDH1A1MAPTHPGD
SCHEMBL14061794 0.77 BCL2 (0.43) BCL2BCL2L1KDM4EALDH1A1MAPT
SCHEMBL15701756 0.74 MAPT (0.44) KDM4EALDH1A1MAPTHPGDHSD17B10
SCHEMBL15701753 0.74 POLB (0.54) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL14061043 0.72 BCL2 (0.52) BCL2BCL2L1
SCHEMBL14061224 0.69 BCL2 (0.69) BCL2BCL2L1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9346795-B2 Substituted sulfonamides useful as antiapoptotic Bcl inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2016-05-24 US disclosed
US-9346795-B2 Substituted sulfonamides useful as antiapoptotic Bcl inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2016-05-24 US disclosed
EP-2714681-B1 SUBSTITUTED SULFONAMIDES USEFUL AS ANTIAPOPTOTIC BCL INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2015-06-24 EP disclosed
EP-2714681-B1 SUBSTITUTED SULFONAMIDES USEFUL AS ANTIAPOPTOTIC BCL INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2015-06-24 EP disclosed
US-20140135318-A1 SUBSTITUTED SULFONAMIDES USEFUL AS ANTIAPOPTOTIC BCL INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2014-05-15 US disclosed
US-20140135318-A1 SUBSTITUTED SULFONAMIDES USEFUL AS ANTIAPOPTOTIC BCL INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2014-05-15 US disclosed
WO-2012162365-A1 SUBSTITUTED SULFONAMIDES USEFUL AS ANTIAPOPTOTIC BCL INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2012-11-29 WO disclosed
WO-2012162365-A1 SUBSTITUTED SULFONAMIDES USEFUL AS ANTIAPOPTOTIC BCL INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2012-11-29 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-20140135318-A1 SUBSTITUTED SULFONAMIDES USEFUL AS ANTIAPOPTOTIC BCL INHIBITORS BCL2, BAX, BCL2A1 BCL2 1/4885BCL2L1 4/4885TRPC1 3654/4885

“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.