SCHEMBL30486440

SCHEMBL30486440

CCc1ccc(N2CCC[C@@H]2C)c(F)c1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 2/20 0.47
▸ AR P10275 2/20 0.41
▸ HRH3 Q9Y5N1 4/20 0.39
▸ GFER P55789 1/20 0.39
▸ TP53 P04637 2/20 0.38
▸ MAPT P10636 1/20 0.38
▸ GPR174 Q9BXC1 2/20 0.38
▸ GAA P10253 1/20 0.36
▸ SMARCA2 P51531 5/20 0.36
▸ PBRM1 Q86U86 5/20 0.36
▸ SMARCA4 P51532 4/20 0.36
▸ NR1I2 O75469 2/20 0.36
▸ NR1H2 P55055 1/20 0.36
▸ LMNA P02545 1/20 0.36

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
SCHEMBL13419464 0.80 TP53 (0.47) ARHRH3GFERTP53MAPT
SCHEMBL24478124 0.79 HTR2C (0.45) —
SCHEMBL13419745 0.79 GFER (0.57) ARGFERTP53MAPTGAA
SCHEMBL21593840 0.79 THRB (0.41) THRBARHRH3GFERTP53
SCHEMBL30009870 0.77 MAPT (0.55) THRBARGFERTP53MAPT
SCHEMBL9983954 0.75 GFER (0.63) THRBGFERTP53MAPTGPR174
SCHEMBL8373055 0.74 MAPT (0.56) MAPTGAALMNA
SCHEMBL8156058 0.74 HRH3 (0.44) THRBARHRH3
SCHEMBL2814598 0.74 MAPT (0.50) GFERMAPTGAALMNA
SCHEMBL28771928 0.74 GAA (0.46) HRH3GFERMAPTGPR174GAA

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
CN-114891003-B Novel dihydropyrimidine compound, intermediate or salt, and preparation method and application thereof 成都施贝康生物医药科技有限公司 2023-10-13 — — CN disclosed
CN-114656472-B Pyrazolopyrimidine compound, isomer or salt, and preparation method and application thereof 成都施贝康生物医药科技有限公司 2023-07-04 — — CN disclosed
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