SCHEMBL11627155

SCHEMBL11627155

CN(C)C(=O)Nc1cccc(CC(=O)N(C)C2CCCCC2)c1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.56
RAB9A P51151 2/20 0.56
ATM Q13315 2/20 0.55
MAP4K4 O95819 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.46
USP30 Q70CQ3 1/20 0.46
TP53 P04637 1/20 0.46
ABL1 P00519 2/20 0.46
RIN1 Q13671 2/20 0.46
ACKR3 P25106 1/20 0.46
CCR5 P51681 2/20 0.44

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
SCHEMBL11631147 0.84 ATM (0.67) POLBRAB9AATMSMN1; SMN2USP30
SCHEMBL11630843 0.82 EPHX2 (0.60) POLBRAB9ASMN1; SMN2ACKR3
SCHEMBL11625498 0.82 TP53 (0.54) TP53
SCHEMBL11630837 0.81 NPC1 (0.65) POLBRAB9AATMSMN1; SMN2ABL1
SCHEMBL11629895 0.81 EPHX2 (0.57) POLBRAB9ASMN1; SMN2ACKR3
SCHEMBL11630554 0.80 CYP19A1 (0.48) POLBRAB9AATMSMN1; SMN2TP53
SCHEMBL11629016 0.80 NPC1 (0.63) POLBRAB9ASMN1; SMN2ABL1RIN1
SCHEMBL11626650 0.79 MAP4K4 (0.57) RAB9AMAP4K4CCR5
SCHEMBL19444606 0.79 CCR5 (0.64) RAB9AMAP4K4SMN1; SMN2TP53CCR5
SCHEMBL11629065 0.79 CYP19A1 (0.47) POLBRAB9AATMSMN1; SMN2TP53

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-4067726-A 3-Ureido phenylacetamide herbicides BAYER AKTIENGESELLSCHAFT (DT) 1978-01-10 US disclosed