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SCHEMBL24637699

SCHEMBL24637699

Cc1ccc(C2(c3ccc(C)cc3)c3cc(-c4ccc(/C=C5\C(=O)c6ccccc6C5=C(C#N)C#N)s4)ccc3-c3cc4c(cc32)-c2cc3cc(-c5ccc(/C=C6\C(=O)c7ccccc7C6=C(C#N)C#N)s5)sc3cc2C4(c2ccc(C)cc2)c2ccc(C)cc2)cc1

nearest known ligand 0.32

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ THRB P10828 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ EGFR P00533 1/20 0.30
▸ RET P07949 1/20 0.30
▸ KDR P35968 1/20 0.30
▸ CTRC Q99895 1/20 0.30
▸ PRF1 P14222 1/20 0.30

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
SCHEMBL24637700 0.94 — —
SCHEMBL24637735 0.91 ALDH1A1 (0.32) ALDH1A1MAPTTHRBHPGDRECQL
SCHEMBL24637686 0.90 EGFR (0.41) ALDH1A1MAPTTHRBHPGDRECQL
SCHEMBL24637687 0.88 EGFR (0.39) ALDH1A1MAPTTHRBHPGDRECQL
SCHEMBL24637708 0.87 — —
SCHEMBL24637731 0.86 EGFR (0.38) ALDH1A1MAPTTHRBHPGDRECQL
SCHEMBL20040226 0.86 — —
SCHEMBL24637712 0.85 KMT2A (0.34) ALDH1A1MAPTTHRBHPGDRECQL
SCHEMBL24637720 0.85 ALDH1A1 (0.30) ALDH1A1MAPTTHRBHPGDRECQL
SCHEMBL24637688 0.84 PRF1 (0.31) ALDH1A1MAPTTHRBHPGDRECQL

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-3306690-B1 ORGANIC SEMICONDUCTING COMPOUNDS RAYNERGY TEK INC (TW) 2022-09-07 — — EP disclosed