SCHEMBL23864206

SCHEMBL23864206

C=C(C)c1cc(Cl)ccc1C(=C)Nc1ccc(CCCC)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.46
▸ IDH1 O75874 1/20 0.43
▸ NPC1 O15118 5/20 0.41
▸ RAB9A P51151 5/20 0.41
▸ SMN1; SMN2 Q16637 4/20 0.41
▸ HPGD P15428 3/20 0.41
▸ ALDH1A1 P00352 3/20 0.40
▸ THRA P10827 2/20 0.40
▸ THRB P10828 2/20 0.40
▸ LMNA P02545 2/20 0.40
▸ KCNK2 O95069 1/20 0.40
▸ MAPT P10636 1/20 0.39
▸ XBP1 P17861 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ NFKB1 P19838 1/20 0.39
▸ NFKB2 Q00653 1/20 0.39
▸ RELA Q04206 1/20 0.39
▸ CA12 O43570 1/20 0.39
▸ CA1 P00915 1/20 0.39

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
SCHEMBL23864623 0.85 ALDH1A1 (0.49) POLBNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL23864215 0.83 POLB (0.44) POLBNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL23864747 0.82 CTRC (0.45) POLBTHRATHRBKCNK2
SCHEMBL23864449 0.80 ALDH1A1 (0.49) POLBNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL23864195 0.78 ALOX15 (0.41) POLBNPC1RAB9AHPGDALOX15
SCHEMBL23864155 0.78 CTRC (0.49) THRATHRBCA1CA2
SCHEMBL16088656 0.75 TRPV1 (0.53) POLBNPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL16088663 0.75 TRPV1 (0.53) NPC1RAB9ASMN1; SMN2ALDH1A1KCNK2
SCHEMBL23864295 0.72 POLB (0.46) POLBNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL23864512 0.72 ITGB1 (0.52) POLBNPC1RAB9ASMN1; SMN2HPGD

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
EP-2968330-B1 COMPOUNDS AND METHODS FOR INDUCING CHONDROGENESIS SCRIPPS RESEARCH INST (US) 2021-09-29 — — EP disclosed
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