SCHEMBL2767478

SCHEMBL2767478

CC(C)CNC(=S)Nc1noc2c(F)cccc12

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
ALDH1A1 P00352 6/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
ALOX12 P18054 2/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
LMNA P02545 2/20 0.39
TP53 P04637 2/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.36
GAA P10253 2/20 0.36
RECQL P46063 1/20 0.36
SSTR4 P31391 1/20 0.35
ALPL P05186 1/20 0.35

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
SCHEMBL2770774 0.86 ALDH1A1 (0.50) KMT2AL3MBTL1ALDH1A1SMN1; SMN2ALOX12
SCHEMBL2768768 0.84 SMN1; SMN2 (0.44) KMT2AALDH1A1SMN1; SMN2ALOX12NPC1
SCHEMBL2770286 0.82 SMN1; SMN2 (0.44) KMT2AALDH1A1SMN1; SMN2LMNATP53
SCHEMBL2770294 0.81 SMN1; SMN2 (0.50) KMT2AL3MBTL1ALDH1A1SMN1; SMN2ALOX12
SCHEMBL2768680 0.81 MEN1 (0.48) KMT2AALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL2769899 0.80 SMN1; SMN2 (0.49) KMT2AL3MBTL1ALDH1A1SMN1; SMN2ALOX12
SCHEMBL2769700 0.80 SMN1; SMN2 (0.49) KMT2AL3MBTL1ALDH1A1SMN1; SMN2ALOX12
SCHEMBL2768663 0.77 RAB9A (0.48) KMT2AL3MBTL1ALDH1A1SMN1; SMN2NPC1
SCHEMBL2767445 0.74 KDM4E (0.56) KMT2AALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL2786181 0.74 SMN1; SMN2 (0.43) SMN1; SMN2LMNATP53SSTR4

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 KMT2A 197/4885L3MBTL1 1736/4885ALDH1A1 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.