SCHEMBL23864571

SCHEMBL23864571

C=C(C)c1ccc(CC)cc1C(=C)NCc1ccc(C)cc1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ KMT2A Q03164 8/20 0.39
▸ NPC1 O15118 4/20 0.38
▸ HPGD P15428 5/20 0.37
▸ ALDH1A1 P00352 4/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ MAPT P10636 1/20 0.36
▸ LMNA P02545 2/20 0.36
▸ RAB9A P51151 3/20 0.36
▸ MEN1 O00255 6/20 0.35
▸ TP53 P04637 1/20 0.35
▸ AKR1C3 P42330 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
SCHEMBL23864490 0.91 KMT2A (0.36) SMN1; SMN2KMT2AALDH1A1KDM4EMAPT
SCHEMBL23864435 0.83 KMT2A (0.38) SMN1; SMN2KMT2AALDH1A1MAPTRAB9A
SCHEMBL23864341 0.82 KMT2A (0.40) KMT2AALDH1A1KDM4EMAPTLMNA
SCHEMBL23864722 0.76 ALDH1A1 (0.40) KMT2AHPGDALDH1A1KDM4ELMNA
SCHEMBL19415763 0.71 TRPA1 (0.42) SMN1; SMN2NPC1ALDH1A1KDM4EMAPT
SCHEMBL24529103 0.71 ALDH1A1 (0.49) SMN1; SMN2KMT2AHPGDALDH1A1KDM4E
SCHEMBL13369666 0.70 SMN1; SMN2 (0.53) SMN1; SMN2KMT2ANPC1HPGDALDH1A1
SCHEMBL23864723 0.70 MAPT (0.37) KMT2AHPGDALDH1A1MAPTLMNA
SCHEMBL23864208 0.69 HPGD (0.32) KMT2AHPGDALDH1A1KDM4ELMNA
SCHEMBL1363368 0.68 TRPA1 (0.42) SMN1; SMN2KMT2ANPC1HPGDALDH1A1

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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