SCHEMBL5943376

SCHEMBL5943376

NC[CH]c1cccc(NC(=O)c2cc(C(N)=O)on2)c1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 7/20 0.43
ALDH1A1 P00352 2/20 0.43
USP2 O75604 1/20 0.43
NPC1 O15118 4/20 0.43
RAB9A P51151 4/20 0.43
MAPK1 P28482 3/20 0.43
TP53 P04637 2/20 0.43
NFKB1 P19838 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
MAPT P10636 1/20 0.42
ACR P10323 5/20 0.42
GAA P10253 1/20 0.42
POLB P06746 1/20 0.40
AURKB Q96GD4 1/20 0.39
GLA P06280 1/20 0.39
HTT P42858 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL4702346 0.85 SMN1; SMN2 (0.39) SMN1; SMN2ALDH1A1USP2NPC1RAB9A
SCHEMBL4704061 0.78 SMN1; SMN2 (0.38) SMN1; SMN2ALDH1A1USP2NPC1RAB9A
SCHEMBL5244156 0.75 F2 (0.46) SMN1; SMN2ALDH1A1NPC1RAB9ATP53
SCHEMBL4705980 0.74 GPR35 (0.43) ALDH1A1MAPK1MAPTPOLBHTT
SCHEMBL4704082 0.67 POLB (0.50) SMN1; SMN2ALDH1A1USP2NPC1RAB9A
SCHEMBL8267163 0.65 SMN1; SMN2 (0.88) SMN1; SMN2ALDH1A1USP2NPC1RAB9A
SCHEMBL15653736 0.64 KMT2A (0.61) MAPK1TP53MAPTGAAPOLB
SCHEMBL30314831 0.64 SCD (0.43) ALDH1A1MAPTGAAPOLB
SCHEMBL10632420 0.64 GRM4 (0.67) SMN1; SMN2NPC1RAB9A
SCHEMBL30439916 0.64 GRM4 (0.67) SMN1; SMN2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060281778-A1 Compounds for inhibiting KSP Kinesin activity SCHERING CORPORATION 2006-12-14 US disclosed
US-20060247320-A1 Compounds for inhibiting KSP kinesin activity SCHERING CORPORATION 2006-11-02 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 (2 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-20060281778-A1 Compounds for inhibiting KSP Kinesin activity KIFC1, KIF5B, KIF2C SMN1; SMN2 2022/4885ALDH1A1 2371/4885USP2 2868/4885
US-20060247320-A1 Compounds for inhibiting KSP kinesin activity KIFC1, KIF5B, KIF2C SMN1; SMN2 2022/4885ALDH1A1 2371/4885USP2 2868/4885

“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.