SCHEMBL2770288

SCHEMBL2770288

CNC(=O)N(S)c1noc2c(F)cccc12

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 9/20 0.39
SMN1; SMN2 Q16637 4/20 0.36
TP53 P04637 1/20 0.36
GAA P10253 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.31
ALDH1A1 P00352 1/20 0.30
GLA P06280 1/20 0.30
NPC1 O15118 2/20 0.30
RAB9A P51151 2/20 0.30

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
SCHEMBL2768773 0.84 SSTR4 (0.39) SSTR4SMN1; SMN2TP53GAAALDH1A1
SCHEMBL2767482 0.83 LMNA (0.39) SSTR4SMN1; SMN2GAAL3MBTL1ALDH1A1
SCHEMBL2770296 0.81 SSTR4 (0.37) SSTR4SMN1; SMN2TP53ALDH1A1NPC1
SCHEMBL2769902 0.81 EPHX2 (0.37) SSTR4ALDH1A1
SCHEMBL2769703 0.81 EPHX2 (0.37) SSTR4ALDH1A1
SCHEMBL2768687 0.78 HIF1A (0.41) SMN1; SMN2TP53NPC1RAB9A
SCHEMBL2767451 0.75 ALDH1A1 (0.48) SMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL2770776 0.73 SMN1; SMN2 (0.46) SSTR4SMN1; SMN2TP53
SCHEMBL13209752 0.68 SSTR4 (0.43) SSTR4SMN1; SMN2TP53L3MBTL1NPC1
SCHEMBL24174035 0.68 SSTR4 (0.43) SSTR4SMN1; SMN2TP53ALDH1A1NPC1

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 SSTR4 3748/4885SMN1; SMN2 1349/4885TP53 4784/4885

“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.