SCHEMBL23864351

SCHEMBL23864351

CC(=O)c1cc(N(O)C(=O)c2ccccc2C(C)=O)ccc1Cl

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 3/20 0.43
▸ TP53 P04637 1/20 0.40
▸ CES2 O00748 2/20 0.38
▸ CES1 P23141 2/20 0.38
▸ ALDH1A1 P00352 5/20 0.37
▸ ABCB1 P08183 1/20 0.36
▸ HPGD P15428 3/20 0.36
▸ LMNA P02545 1/20 0.36
▸ TSHR P16473 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ EGFR P00533 1/20 0.35
▸ ALK Q9UM73 1/20 0.35

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
SCHEMBL23864569 0.82 LMNA (0.40) TP53CES2CES1ALDH1A1HPGD
SCHEMBL23864358 0.74 KDM4C (0.39) TP53ALDH1A1LMNASMN1; SMN2
SCHEMBL23864713 0.74 KDM4E (0.36) POLBALDH1A1HPGDLMNATSHR
SCHEMBL23864607 0.74 HPGD (0.49) ALDH1A1HPGD
SCHEMBL23864250 0.72 LOXL2 (0.39) TP53ALDH1A1TSHRSMN1; SMN2
SCHEMBL23864419 0.72 CRHBP (0.37) TP53ALDH1A1HPGDSMN1; SMN2
SCHEMBL23864317 0.71 CASP3 (0.36) ALDH1A1HPGDLMNA
SCHEMBL23864287 0.71 CA2 (0.41) POLBTP53ALDH1A1LMNA
SCHEMBL55443 0.70 CES2 (0.65) POLBTP53CES2CES1ALDH1A1
SCHEMBL17187884 0.70 CES2 (0.65) POLBTP53CES2CES1ALDH1A1

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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