SCHEMBL30759702

SCHEMBL30759702

CCCn1nc(C(=O)OCC)c2c1-c1cc(Br)c(OC)cc1CC2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNK3 O14649 2/20 0.44
▸ ALDH1A1 P00352 2/20 0.41
▸ CCNA2 P20248 3/20 0.40
▸ CDK2 P24941 3/20 0.40
▸ CCNA1 P78396 3/20 0.40
▸ KMT2A Q03164 2/20 0.39
▸ CDK4 P11802 1/20 0.39
▸ CCND3 P30281 1/20 0.39
▸ CDK6 Q00534 1/20 0.39
▸ TSHR P16473 2/20 0.38
▸ LMNA P02545 2/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ HTT P42858 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.35
▸ TP53 P04637 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ TUBB4A P04350 1/20 0.34
▸ TUBB P07437 1/20 0.34
▸ TUBA3C P0DPH7 1/20 0.34
▸ TUBA1B P68363 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
SCHEMBL27122568 1.00 KCNK3 (0.44) KCNK3ALDH1A1CCNA2CDK2CCNA1
SCHEMBL30759542 0.94 KCNK3 (0.43) KCNK3ALDH1A1CCNA2CDK2CCNA1
SCHEMBL27123055 0.94 KCNK3 (0.43) KCNK3ALDH1A1CCNA2CDK2CCNA1
SCHEMBL30759643 0.89 KCNK3 (0.35) KCNK3CCNA2CDK2CCNA1KMT2A
SCHEMBL27122940 0.89 CCNA2 (0.47) KCNK3ALDH1A1CCNA2CDK2CCNA1
SCHEMBL30759580 0.89 CCNA2 (0.47) KCNK3ALDH1A1CCNA2CDK2CCNA1
SCHEMBL27122571 0.89 KCNK3 (0.35) KCNK3CCNA2CDK2CCNA1KMT2A
SCHEMBL27125849 0.88 KCNK3 (0.43) KCNK3ALDH1A1CCNA2CDK2CCNA1
SCHEMBL30759696 0.88 KCNK3 (0.43) KCNK3ALDH1A1CCNA2CDK2CCNA1
SCHEMBL30759680 0.85 CCNA2 (0.49) KCNK3ALDH1A1CCNA2CDK2CCNA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4577206-A2 NOVEL MODULATORS OF FSHR AND USES THEREOF Celmatix Inc. (US) 2025-07-02 — — EP disclosed
WO-2024044778-A2 NOVEL MODULATORS OF FSHR AND USES THEREOF CELMATIX INC. (US) 2024-02-29 — — WO disclosed
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