SCHEMBL30569751

SCHEMBL30569751

O=c1cc(Cl)c2cc(-c3ccc(F)cc3)ccc2[nH]1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TNKS2 Q9H2K2 4/20 0.56
▸ AR P10275 1/20 0.50
▸ PDE3B Q13370 1/20 0.43
▸ PDE3A Q14432 1/20 0.43
▸ LMNA P02545 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.42
▸ CTSV O60911 1/20 0.42
▸ CTSL P07711 1/20 0.42
▸ PGR P06401 1/20 0.41
▸ KDR P35968 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ PDPK1 O15530 1/20 0.39
▸ FASN P49327 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ GLA P06280 1/20 0.38
▸ GAA P10253 1/20 0.38

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
SCHEMBL1771271 0.78 AR (0.61) TNKS2AR
SCHEMBL27977589 0.77 TNKS2 (0.49) TNKS2CTSVCTSLPGRSMN1; SMN2
SCHEMBL2798042 0.76 TNKS2 (0.50) TNKS2ARLMNAMEN1KMT2A
SCHEMBL12075227 0.75 KDM4E (0.57) TNKS2PDE3BPDE3ALMNAMEN1
SCHEMBL31441277 0.73 CA12 (0.49) TNKS2PDE3BPDE3ACTSVCTSL
SCHEMBL20680204 0.73 AR (0.51) TNKS2ARLMNAMEN1KMT2A
SCHEMBL8210948 0.73 LMNA (0.56) TNKS2ARLMNAMEN1KMT2A
SCHEMBL20838314 0.73 AR (0.51) ARLMNAMEN1KMT2ARXFP1
SCHEMBL1771208 0.73 AR (0.58) TNKS2ARLMNAMEN1KMT2A
SCHEMBL29722191 0.72 AR (0.58) ARLMNAMEN1KMT2AKDM4E

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
CN-116583510-A (aza) quinolin-4-amine derivatives as P2X3 inhibitors 奇斯药制品公司 2023-08-11 — — CN disclosed
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