SCHEMBL31648798

SCHEMBL31648798

Cc1ccc(C)c(C2CCCN2C(=O)Cn2nc3c(c2C)CCC[C@@H]3C)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ YAP1 P46937 1/20 0.39
▸ TEAD4 Q15561 1/20 0.39
▸ KDM4E B2RXH2 5/20 0.39
▸ GAA P10253 3/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ USP2 O75604 2/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ GLA P06280 1/20 0.36
▸ TP53 P04637 1/20 0.35
▸ MAPT P10636 3/20 0.35
▸ LMNA P02545 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ HSP90AA1 P07900 5/20 0.34
▸ HSP90AB1 P08238 5/20 0.34
▸ PAX8 Q06710 1/20 0.34

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
SCHEMBL31648942 1.00 MEN1 (0.39) MEN1KMT2AYAP1TEAD4KDM4E
SCHEMBL31648045 0.88 HSP90AA1 (0.44) MEN1KMT2AGAAALDH1A1TP53
SCHEMBL31648577 0.85 HSP90AA1 (0.36) MEN1KMT2AGAATP53MAPT
SCHEMBL31648052 0.81 PPIB (0.39) ALOX15HSP90AA1HSP90AB1
SCHEMBL31648823 0.79 PPIB (0.38) HSP90AA1HSP90AB1
SCHEMBL31648466 0.76 PPIB (0.40) ALOX15HSP90AA1HSP90AB1
SCHEMBL31648538 0.76 PPIB (0.40) ALOX15HSP90AA1HSP90AB1
SCHEMBL31648311 0.73 ALDH1A1 (0.44) KMT2AGAAALDH1A1TP53LMNA
Lithium Ion SCHEMBL31648320 0.71 POLQ (0.35) —
SCHEMBL31648183 0.69 ALDH1A1 (0.41) MEN1KMT2AKDM4EGAAALDH1A1

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
WO-2025132946-A1 PHENYLPYRROLIDINE DERIVATIVES AND THEIR USE AS POI-THETA DERIVATIVES BREAKPOINT THERAPEUTICS GMBH (DE) 2025-06-26 — — WO disclosed
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