SCHEMBL15907221

SCHEMBL15907221

Cc1cnc(NC(=O)c2ccc(C(N)=O)cc2)cc1Br

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MTOR P42345 2/20 0.56
▸ MAP3K5 Q99683 5/20 0.45
▸ RAB9A P51151 6/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ TP53 P04637 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ NFKB1 P19838 1/20 0.45
▸ NFKB2 Q00653 1/20 0.45
▸ RELA Q04206 1/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ NNMT P40261 2/20 0.44
▸ NPC1 O15118 5/20 0.44
▸ POLB P06746 1/20 0.44
▸ CCNA2 P20248 2/20 0.44
▸ CDK2 P24941 2/20 0.44
▸ CCNA1 P78396 2/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ RXFP1 Q9HBX9 1/20 0.43
▸ ABL1 P00519 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
SCHEMBL18323129 0.81 F10 (0.45) MTORMAP3K5RAB9ASMN1; SMN2NPC1
SCHEMBL15907179 0.78 RAB9A (0.52) MTORRAB9ASMN1; SMN2KDM4ENPC1
SCHEMBL15907219 0.78 MTOR (0.57) MTORRAB9ASMN1; SMN2TP53KDM4E
SCHEMBL624251 0.76 L3MBTL1 (0.53) MTORRAB9ASMN1; SMN2KDM4ENPC1
SCHEMBL25223673 0.75 PTGS1 (0.62) MTORRAB9ATSHRMEN1KMT2A
SCHEMBL31627738 0.73 MTOR (0.44) MTORRAB9ASMN1; SMN2TP53NPC1
SCHEMBL15907218 0.70 MTOR (0.43) MTORRAB9ASMN1; SMN2TP53NPC1
SCHEMBL15907222 0.70 MTOR (0.43) MTORMAP3K5RAB9ASMN1; SMN2TP53
SCHEMBL11308749 0.69 HCAR3 (0.77) RAB9ASMN1; SMN2KDM4ENNMTNPC1
SCHEMBL15308200 0.69 KMT2A (0.57) RAB9AKDM4ENPC1POLBCCNA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140213592-A1 Protein Kinase Inhibitors (Variants), Use Thereof in Treating Oncological Diseases and a Pharmaceutical Composition Based Thereon OBSHCHESTVO S OGRANICHENNOY OTVETSTVENNOSTYOU "FUSION PHARMA" (RU) 2014-07-31 — — 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-20140213592-A1 Protein Kinase Inhibitors (Variants), Use Thereof in Treating Oncological Diseases and a Pharmaceutical Composition Based Thereon ABL1, ABL2, MAP3K6 MTOR 348/4885MAP3K5 9/4885RAB9A 1864/4885

“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.

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