SCHEMBL29980773

SCHEMBL29980773

c1ccc2c(c1)CCC2N=NC1CCc2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 4/20 0.48
PDPK1 O15530 1/20 0.48
CYP11B2 P19099 1/20 0.46
RET P07949 1/20 0.42
HTR2A P28223 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
SIGMAR1 Q99720 1/20 0.41
HTR6 P50406 1/20 0.41

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
SCHEMBL2322453 0.86 IDO1 (0.48) IDO1PDPK1CYP11B2RETHTR2A
SCHEMBL4185301 0.83 IDO1 (0.46) IDO1PDPK1CYP11B2RETHTR2A
SCHEMBL8664434 0.83 IDO1 (0.46) IDO1PDPK1CYP11B2RETHTR2A
SCHEMBL2400656 0.83 PDPK1 (0.50) IDO1PDPK1CYP11B2SIGMAR1HTR6
SCHEMBL5085348 0.83 PDPK1 (0.50) IDO1PDPK1CYP11B2SIGMAR1HTR6
SCHEMBL20321008 0.83 IDO1 (0.46) IDO1PDPK1CYP11B2RETHTR2A
SCHEMBL13435342 0.78 IDO1 (0.42) IDO1PDPK1CYP11B2SIGMAR1
SCHEMBL1922245 0.78 IDO1 (0.42) IDO1PDPK1CYP11B2CA1CA2
SCHEMBL17948401 0.78 IDO1 (0.42) IDO1PDPK1CYP11B2RETHTR2A
SCHEMBL1148693 0.78 IDO1 (0.42) IDO1PDPK1CYP11B2CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120019035-A Interlayer for laminated glass and laminated glass 积水化学工业株式会社 2025-05-16 CN disclosed
CN-119947994-A Interlayer film for laminated glass, and method for producing same 积水化学工业株式会社 2025-05-06 CN disclosed
CN-115298198-A Novel compounds and compositions for targeted therapy of kidney-related cancers 上海盟科药业股份有限公司 2022-11-04 CN disclosed