SCHEMBL4781489

SCHEMBL4781489

COCCN(C)Cc1csc(N)n1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
NPC1 O15118 3/20 0.43
CNR1 P21554 3/20 0.41
KCNH2 Q12809 3/20 0.41
ALDH1A1 P00352 2/20 0.41
GABRA5 P31644 1/20 0.39
GABRB2 P47870 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MAPT P10636 1/20 0.39
NOS1 P29475 1/20 0.37
ATM Q13315 1/20 0.37
MAP4K4 O95819 1/20 0.37
PRMT1 Q99873 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
SCHEMBL353434 0.77 SMN1; SMN2 (0.47) RAB9ASMN1; SMN2NPC1ALDH1A1GABRA5
SCHEMBL4970134 0.76 SMN1; SMN2 (0.59) RAB9ASMN1; SMN2NPC1ALDH1A1GABRA5
SCHEMBL5913878 0.76 HSD17B10 (0.48) RAB9ASMN1; SMN2NPC1ALDH1A1GABRA5
Hydrochloric Acid SCHEMBL308085 0.74 HSD17B10 (0.47) RAB9ASMN1; SMN2NPC1ALDH1A1GABRA5
SCHEMBL5216503 0.73 GABRA5 (0.40) RAB9ASMN1; SMN2NPC1ALDH1A1GABRA5
SCHEMBL958545 0.72
SCHEMBL18284087 0.72 MAP4K4 (0.37) CNR1KCNH2ALDH1A1MAPTMAP4K4
Hydrochloric Acid SCHEMBL4796242 0.71 SMN1; SMN2 (0.53) RAB9ASMN1; SMN2NPC1ALDH1A1GABRA5
Hydrochloric Acid SCHEMBL4780449 0.71 RAB9A (0.60) RAB9ASMN1; SMN2NPC1ALDH1A1GABRA5
SCHEMBL5221488 0.70 HSD17B10 (0.43) RAB9ASMN1; SMN2NPC1ALDH1A1GABRA5

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
US-8716320-B2 Antibacteriall heterocyclic ureas REPLIDYNE, INC. (US) 2014-05-06 US disclosed
US-20080207703-A1 Antibacterial heterocyclic ureas REPLIDYNE, INC. (US) 2008-08-28 US disclosed
WO-2008011191-A1 ANTIBACTERIAL HETEROCYCLIC UREAS REPLIDYNE, INC. (US) 2008-01-24 WO 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-20080207703-A1 Antibacterial heterocyclic ureas UMPS, UROD, UGP2 RAB9A 1509/4885SMN1; SMN2 4077/4885NPC1 2049/4885

“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.