SCHEMBL9600939

SCHEMBL9600939

Cn1ccc2c(Cl)nncc21

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 4/20 0.39
PIK3CB P42338 1/20 0.33
DHFR P00374 1/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
NQO2 P16083 1/20 0.32
RHEB Q15382 1/20 0.30
P2RX7 Q99572 1/20 0.30

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
SCHEMBL13556612 0.78 HSD11B1 (0.37) HSD11B1PIK3CBDHFRKDM4EALDH1A1
SCHEMBL31083400 0.77 DHFR (0.42) HSD11B1PIK3CBDHFRKDM4EALDH1A1
SCHEMBL31366395 0.74 PIK3CB (0.39) HSD11B1PIK3CBDHFRKDM4EALDH1A1
SCHEMBL20631805 0.74 ALDH1A1 (0.39) HSD11B1PIK3CBDHFRKDM4EALDH1A1
SCHEMBL18494455 0.71 RXFP1 (0.42) HSD11B1PIK3CBDHFRKDM4EALDH1A1
SCHEMBL31447623 0.71 PI4KA (0.35) ALDH1A1
SCHEMBL13787643 0.71 PI4KA (0.35) ALDH1A1
SCHEMBL30110619 0.71 RXFP1 (0.42) HSD11B1PIK3CBDHFRKDM4EALDH1A1
SCHEMBL25072439 0.69 HSD11B1 (0.35) HSD11B1ALDH1A1
SCHEMBL30718312 0.69 HSD11B1 (0.35) HSD11B1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025082069-A1 COMPOUND BINDING TO CRBN PROTEIN AND DEGRADATION AGENT OF PROTEIN 中国海洋大学 2025-04-24 WO disclosed
CN-119841843-A Compound combined with CRBN protein and degradation agent of CRBN protein 中国海洋大学 2025-04-18 CN disclosed
EP-0225182-B1 CEPHALOSPORIN COMPOUNDS ICI PHARMA (FR) 1993-02-10 EP disclosed
US-5013731-A Bactericides ICI PHARMA (FR) 1991-05-07 US disclosed
EP-0225182-A2 Cephalosporin compounds ICI PHARMA (FR) 1987-06-10 EP disclosed