SCHEMBL9347698

SCHEMBL9347698

CCC(=O)N(C)Cc1ccncc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.50
NPC1 O15118 3/20 0.50
MMP13 P45452 1/20 0.49
ALDH1A1 P00352 4/20 0.46
HTT P42858 3/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 4/20 0.45
KDM4E B2RXH2 1/20 0.45
USP2 O75604 2/20 0.44
PYGL P06737 1/20 0.43
TSPO P30536 1/20 0.43
PKM P14618 1/20 0.42
RECQL P46063 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
HSD17B10 Q99714 1/20 0.42
TSHR P16473 1/20 0.42
NAMPT P43490 1/20 0.42
CA12 O43570 1/20 0.42
CA9 Q16790 1/20 0.42

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
SCHEMBL11172546 0.86 RAB9A (0.56) RAB9ANPC1MMP13ALDH1A1HTT
SCHEMBL19210473 0.82 MMP13 (0.53) RAB9ANPC1MMP13KMT2AUSP2
SCHEMBL14524621 0.82 CYP1A2 (0.42) RAB9ANPC1KMT2ASMN1; SMN2NPSR1
SCHEMBL9546454 0.81 ALDH1A1 (0.54) RAB9ANPC1MMP13ALDH1A1HTT
SCHEMBL3163935 0.81 NPC1 (0.75) RAB9ANPC1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL27325881 0.81 MMP13 (0.51) RAB9ANPC1MMP13ALDH1A1HTT
SCHEMBL18997622 0.81 RAB9A (0.46) RAB9ANPC1MMP13ALDH1A1HTT
SCHEMBL12672893 0.80 USP2 (0.57) ALDH1A1KMT2AUSP2TSPOHSD17B10
SCHEMBL6619359 0.80 RIPK1 (0.65) RAB9ANPC1ALDH1A1KMT2APYGL
SCHEMBL11177738 0.79 MMP13 (0.50) RAB9ANPC1MMP13ALDH1A1HTT

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-8026368-B2 Hydrazide compounds and thrombopoietin receptor activators NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2011-09-27 US disclosed
US-20090253751-A1 HYDRAZIDE COMPOUND AND THROMBOPOIETIN RECEPTOR ACTIVATOR NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2009-10-08 US disclosed
US-5338738-A Cerebral function enhancers: acyclic amide derivatives of pyrimidinylpiperidines BRISTOL-MYERS SQUIBB COMPANY (US) 1994-08-16 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-20090253751-A1 HYDRAZIDE COMPOUND AND THROMBOPOIETIN RECEPTOR ACTIVATOR TEK, THPO, PTAFR RAB9A 1952/4885NPC1 3369/4885MMP13 561/4885

“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.