SCHEMBL92286

SCHEMBL92286

Cc1ccc(NC(=O)c2noc3ccccc23)c(Cl)c1

nearest known ligand 0.73

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 16/20 0.73
RAB9A P51151 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.51
MEN1 O00255 1/20 0.49
POLB P06746 1/20 0.49
KMT2A Q03164 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
TP53 P04637 1/20 0.49
RXFP1 Q9HBX9 1/20 0.49

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
SCHEMBL92287 0.88 SMN1; SMN2 (0.65) HIF1ARAB9ASMN1; SMN2
SCHEMBL92200 0.86 HIF1A (0.70) HIF1A
SCHEMBL92201 0.85 HIF1A (0.58) HIF1ARAB9ASMN1; SMN2
SCHEMBL92253 0.83 HIF1A (0.76) HIF1ASMN1; SMN2MEN1KMT2A
SCHEMBL92251 0.82 HIF1A (0.65) HIF1ASMN1; SMN2TP53
SCHEMBL24479561 0.78 MAPT (0.71) RAB9ASMN1; SMN2MEN1POLBKMT2A
SCHEMBL10273937 0.77 THRB (0.56) RAB9AMEN1POLBKMT2ATDP1
SCHEMBL91543 0.77 RAB9A (0.64) RAB9A
SCHEMBL91540 0.76 RAB9A (0.55) RAB9ASMN1; SMN2MEN1POLBKMT2A
SCHEMBL92533 0.76 MAPT (0.60) RAB9ASMN1; SMN2POLBTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130065882-A1 VLA-4 inhibitory drug MACHINAGA NOBUO (JP) 2013-03-14 US disclosed
US-20120157437-A1 VLA-4 INHIBITORY DRUG DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-06-21 US disclosed
US-8129366-B2 VLA-4 inhibitory drug DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-03-06 US disclosed
US-20090233901-A1 VLA-4 INHIBITORY DRUG DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-09-17 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 (3 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-20120157437-A1 VLA-4 INHIBITORY DRUG VCAM1, ITGB4, ITGA4 HIF1A 652/4885RAB9A 1503/4885SMN1; SMN2 4739/4885
US-20130065882-A1 VLA-4 inhibitory drug VCAM1, ITGB4, ITGA4 HIF1A 594/4885RAB9A 1491/4885SMN1; SMN2 4702/4885
US-20090233901-A1 VLA-4 INHIBITORY DRUG VCAM1, ITGB4, ITGA4 HIF1A 980/4885RAB9A 1187/4885SMN1; SMN2 4787/4885

“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.