SCHEMBL315371

SCHEMBL315371

CCc1nc(-c2cc[c]cc2)no1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACACB O00763 2/20 0.55
ACACA Q13085 2/20 0.55
APOBEC3A P31941 1/20 0.48
APOBEC3G Q9HC16 1/20 0.48
NPC1 O15118 6/20 0.47
RAB9A P51151 6/20 0.47
SMN1; SMN2 Q16637 5/20 0.47
HTT P42858 1/20 0.47
NOTUM Q6P988 3/20 0.46
HTR1A P08908 1/20 0.45
HRH3 Q9Y5N1 1/20 0.45
MAPT P10636 3/20 0.44
POLB P06746 1/20 0.44
CYP1A2 P05177 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
CYP2C19 P33261 1/20 0.44
TSHR P16473 4/20 0.43
MAPK1 P28482 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
CASP3 P42574 1/20 0.43

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
SCHEMBL3112739 0.83 SMN1; SMN2 (0.50) NPC1RAB9ASMN1; SMN2HTTNOTUM
SCHEMBL3117537 0.82 NOTUM (0.65) NPC1RAB9ASMN1; SMN2HTTNOTUM
SCHEMBL91541 0.81 NOTUM (0.68) ACACBACACANPC1RAB9ASMN1; SMN2
SCHEMBL28668539 0.81 RAB9A (0.52) ACACBACACANPC1RAB9ASMN1; SMN2
SCHEMBL27548991 0.81 PPARA (0.59) NPC1RAB9ASMN1; SMN2HTTL3MBTL1
SCHEMBL27454679 0.81 PPARA (0.59) NPC1RAB9ASMN1; SMN2HTTL3MBTL1
SCHEMBL315338 0.80 ACACB (0.47) ACACBACACAAPOBEC3AAPOBEC3GNPC1
SCHEMBL10053485 0.80 SMN1; SMN2 (0.63) ACACBACACANPC1RAB9ASMN1; SMN2
SCHEMBL12525780 0.80 MAPT (0.61) ACACBACACANPC1RAB9ASMN1; SMN2
SCHEMBL3119605 0.79 RAB9A (0.49) NPC1RAB9ASMN1; SMN2HTTNOTUM

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-8093400-B2 Compounds useful in therapy PFIZER INC. (US) 2012-01-10 US disclosed
US-20100317652-A1 Compounds Useful In Therapy PFIZER INC 2010-12-16 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-20100317652-A1 Compounds Useful In Therapy AVPR1A, AVPR1B, AVPR2 ACACB 4425/4885ACACA 3583/4885APOBEC3A 4733/4885

“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.