SCHEMBL977962

SCHEMBL977962

Cc1nc2cc(NC(=O)O)ccn2c1C

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.41
RAB9A P51151 4/20 0.41
GAA P10253 4/20 0.41
NPC1 O15118 3/20 0.41
LMNA P02545 2/20 0.41
ALDH1A1 P00352 4/20 0.39
KDM4E B2RXH2 3/20 0.39
GLA P06280 1/20 0.37
AKT1 P31749 1/20 0.37
AKT2 P31751 1/20 0.37
TP53 P04637 1/20 0.37
HSD17B10 Q99714 1/20 0.37
KMT2A Q03164 1/20 0.36

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
SCHEMBL21646461 0.80 ALDH1A1 (0.38) SMN1; SMN2RAB9AGAANPC1LMNA
SCHEMBL973778 0.78 TDP1 (0.45) SMN1; SMN2RAB9AGAANPC1ALDH1A1
SCHEMBL22124434 0.76 SMN1; SMN2 (0.36) SMN1; SMN2RAB9AGAANPC1LMNA
SCHEMBL25124552 0.76 KDM4E (0.35) SMN1; SMN2GAALMNAALDH1A1KDM4E
SCHEMBL976070 0.74 KDM4E (0.48) SMN1; SMN2RAB9AGAALMNAALDH1A1
SCHEMBL22123606 0.74 GPR139 (0.37) SMN1; SMN2RAB9AGAANPC1LMNA
SCHEMBL17434230 0.74 HDAC1 (0.45)
SCHEMBL31212121 0.73 AKT1 (0.40) SMN1; SMN2GAALMNAALDH1A1KDM4E
SCHEMBL12832208 0.72 ALDH1A1 (0.59) SMN1; SMN2GAALMNAALDH1A1KDM4E
SCHEMBL22123576 0.72 RIPK1 (0.36) SMN1; SMN2RAB9AGAANPC1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2235016-B1 AZABICYCLIC CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2013-09-18 EP disclosed
US-8394820-B2 N-azabicyclic carboxamide derivatives, preparation thereof and therapeutic use thereof SANOFI (FR) 2013-03-12 US disclosed
US-20110009444-A1 N-AZABICYCLIC CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2011-01-13 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-20110009444-A1 N-AZABICYCLIC CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF XDH, NQO2, SLC28A2 SMN1; SMN2 1410/4885RAB9A 2026/4885GAA 547/4885

“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.