SCHEMBL30006359

SCHEMBL30006359

CC(=O)NCc1cccc(F)c1

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SRC P12931 2/20 0.56
RAB9A P51151 2/20 0.55
MAPK1 P28482 1/20 0.55
ANPEP P15144 1/20 0.53
EPHX2 P34913 1/20 0.53
POLB P06746 1/20 0.52
ALDH1A1 P00352 1/20 0.51
TP53 P04637 1/20 0.50
CASP3 P42574 1/20 0.50

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
SCHEMBL885310 1.00 SRC (0.56) SRCRAB9AMAPK1ANPEPEPHX2
SCHEMBL27807493 0.92 EPHX2 (0.51) SRCRAB9AMAPK1ANPEPEPHX2
SCHEMBL1899410 0.87 NPSR1 (0.57) RAB9APOLBALDH1A1
SCHEMBL18198062 0.85 MPO (0.52) SRCRAB9AMAPK1EPHX2
SCHEMBL3109722 0.84 SRC (0.61) SRCRAB9AMAPK1ANPEPEPHX2
SCHEMBL29699631 0.84 SRC (0.61) SRCRAB9AMAPK1ANPEPEPHX2
SCHEMBL9269432 0.83 ANPEP (0.58) SRCRAB9AMAPK1ANPEPEPHX2
SCHEMBL5390715 0.83 SRC (0.61) SRCRAB9AMAPK1ANPEPEPHX2
SCHEMBL1010528 0.83 TAAR1 (0.62) ALDH1A1TP53
SCHEMBL12840938 0.83 SRC (0.54) SRCRAB9AMAPK1ANPEPPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115636798-A Preparation method and application of substituted triaminotriazine compound 中国人民解放军海军军医大学 2023-01-24 CN claimed
CN-122036718-A ALK5 inhibitor and preparation method and application thereof 安炎达医药技术(广州)有限公司 2026-05-15 CN disclosed
CN-115636798-B Preparation method and application of substituted triamino triazine compound 中国人民解放军海军军医大学 2025-05-16 CN disclosed
CN-115636798-A Preparation method and application of substituted triaminotriazine compound 中国人民解放军海军军医大学 2023-01-24 CN disclosed