SCHEMBL29501798

SCHEMBL29501798

CCCCC1(CCCC)c2cc(CCCC3CCCCC3)ccc2-c2ccc(C(=O)c3ccccc3C)cc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHRM1 P11229 2/20 0.38
▸ BCHE P06276 2/20 0.38
▸ CHRM2 P08172 1/20 0.38
▸ CHRM4 P08173 1/20 0.38
▸ HTR1A P08908 1/20 0.38
▸ CHRM5 P08912 1/20 0.38
▸ ADRA2A P08913 1/20 0.38
▸ DRD2 P14416 1/20 0.38
▸ ADRA2B P18089 1/20 0.38
▸ CHRM3 P20309 1/20 0.38
▸ DRD4 P21917 1/20 0.38
▸ ADRA1D P25100 1/20 0.38
▸ ADRA1A P35348 1/20 0.38
▸ HRH1 P35367 1/20 0.38
▸ ADRA1B P35368 1/20 0.38
▸ FNTA P49354 1/20 0.35
▸ FNTB P49356 1/20 0.35
▸ CCR5 P51681 1/20 0.35
▸ PPARG P37231 2/20 0.33
▸ BDKRB2 P30411 1/20 0.33

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
SCHEMBL29620213 0.84 FFAR1 (0.36) CHRM1CHRM2CHRM4HTR1ACHRM5
SCHEMBL21168758 0.80 PDK2 (0.41) —
Acetic Acid SCHEMBL29503085 0.79 FFAR1 (0.35) CHRM1CHRM2CHRM4HTR1ACHRM5
Acetic Acid SCHEMBL28414198 0.79 FFAR1 (0.35) CHRM1CHRM2CHRM4HTR1ACHRM5
SCHEMBL24426196 0.77 P2RX7 (0.36) CHRM2CCR5FFAR1
SCHEMBL18122998 0.75 MEN1 (0.35) CHRM1CHRM2CHRM4HTR1ACHRM5
SCHEMBL28403051 0.75 PDK2 (0.41) —
SCHEMBL17084351 0.73 ALDH1A1 (0.42) —
SCHEMBL23805888 0.73 ALDH1A1 (0.39) CHRM1CHRM2CHRM4HTR1ACHRM5
SCHEMBL17084352 0.72 PDK2 (0.42) —

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
CN-111752099-B Photosensitive resin composition, application thereof, color filter and image display device 常州强力电子新材料股份有限公司 2022-03-22 — — CN disclosed
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