SCHEMBL2769004

SCHEMBL2769004

Cc1ccc(NC(=S)Nc2noc3ccccc23)cc1Cl

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPIA P62937 3/20 0.49
ALDH1A1 P00352 10/20 0.49
MAPT P10636 8/20 0.49
MEN1 O00255 6/20 0.49
KMT2A Q03164 6/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
GAA P10253 4/20 0.49
RAB9A P51151 3/20 0.49
NPC1 O15118 2/20 0.49
RXFP1 Q9HBX9 1/20 0.49
TP53 P04637 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
KIT P10721 1/20 0.44
KDR P35968 1/20 0.44
FLT3 P36888 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
SCHEMBL14805006 0.82 EPHX2 (0.62) ALDH1A1MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL2769319 0.79 ALDH1A1 (0.55) ALDH1A1MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL2768541 0.79 MAPT (0.56) ALDH1A1MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL2772189 0.77 HIF1A (0.58) ALDH1A1MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL2771566 0.77 ALDH1A1 (0.50) PPIAALDH1A1MAPTMEN1KMT2A
SCHEMBL2771187 0.77 SMN1; SMN2 (0.61) ALDH1A1MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL2768326 0.77 HIF1A (0.60) ALDH1A1MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL2768846 0.76 HIF1A (0.64) ALDH1A1MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL2768684 0.75 SMN1; SMN2 (0.51) ALDH1A1MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL2768457 0.75 ALDH1A1 (0.52) ALDH1A1MAPTMEN1KMT2ASMN1; SMN2

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
EP-1881967-B1 SUBSTITUTED BENZO(D)ISOXAZOL-3-YL AMINE COMPOUNDS AS ANALGESICS GRUENENTHAL GMBH (DE) 2010-04-28 EP claimed
US-20080176915-A1 Substituted Benzo[d]isoxazol-3-yl Amine Compounds as Analgesics GRUENENTHAL GMBH (DE) 2008-07-24 US claimed
US-7696238-B2 Substituted benzo[d]isoxazol-3-yl amine compounds as analgesics GRUENENTHAL GMBH (DE) 2010-04-13 US disclosed
US-20080176915-A1 Substituted Benzo[d]isoxazol-3-yl Amine Compounds as Analgesics GRUENENTHAL GMBH (DE) 2008-07-24 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 (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-20080176915-A1 Substituted Benzo[d]isoxazol-3-yl Amine Compounds as Analgesics KCNQ1, KCNQ2, KCNQ3 PPIA 3661/4885ALDH1A1 1965/4885MAPT 2492/4885

“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.