SCHEMBL3958735

SCHEMBL3958735

Cc1nc2cc(NC(=O)Nc3ccc(C(F)(F)F)cc3)ccc2o1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.74
SMN1; SMN2 Q16637 3/20 0.74
NPC1 O15118 3/20 0.74
STAT1 P42224 1/20 0.74
L3MBTL1 Q9Y468 1/20 0.74
POLB P06746 3/20 0.71
MEN1 O00255 3/20 0.71
KMT2A Q03164 3/20 0.71
MAPT P10636 3/20 0.71
KDM4E B2RXH2 2/20 0.71
LMNA P02545 2/20 0.68
EPHX2 P34913 2/20 0.55
ALDH1A1 P00352 2/20 0.55
MAPK1 P28482 2/20 0.55
TP53 P04637 1/20 0.55
HTT P42858 2/20 0.50
BAZ1A Q9NRL2 1/20 0.50
MTOR P42345 1/20 0.50
GAA P10253 1/20 0.49
HSD17B10 Q99714 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
SCHEMBL3961707 0.89 RAB9A (0.66) RAB9ASMN1; SMN2NPC1STAT1L3MBTL1
SCHEMBL5444262 0.88 RAB9A (0.74) RAB9ASMN1; SMN2NPC1STAT1L3MBTL1
SCHEMBL2490209 0.78 RAB9A (0.72) RAB9ASMN1; SMN2NPC1STAT1L3MBTL1
SCHEMBL7988985 0.78 L3MBTL1 (0.51) RAB9ASMN1; SMN2NPC1STAT1L3MBTL1
SCHEMBL5783983 0.78 TRPV1 (0.60) RAB9ASMN1; SMN2NPC1STAT1L3MBTL1
SCHEMBL2244953 0.76 NPC1 (0.72) RAB9ASMN1; SMN2NPC1POLBMEN1
SCHEMBL28729179 0.74 EPHX2 (1.00) RAB9ANPC1MEN1KMT2AMAPT
SCHEMBL11003408 0.74 EPHX2 (1.00) RAB9ANPC1MEN1KMT2AMAPT
SCHEMBL14470501 0.74 RAB9A (0.66) RAB9ASMN1; SMN2NPC1STAT1L3MBTL1
SCHEMBL8029533 0.74 RAB9A (0.65) RAB9ASMN1; SMN2NPC1STAT1L3MBTL1

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-20090082395-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2009-03-26 US claimed
US-20090082395-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2009-03-26 US disclosed
US-20090082395-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2009-03-26 US disclosed
US-20090082395-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2009-03-26 US disclosed
WO-2009035951-A2 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. (US) 2009-03-19 WO disclosed
WO-2009035951-A2 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. (US) 2009-03-19 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-20090082395-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS EPHX1, EPHX2, LTA4H RAB9A 3264/4885SMN1; SMN2 4670/4885NPC1 1965/4885

“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.