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SCHEMBL24637686

SCHEMBL24637686

Cc1ccc(C2(c3ccc(C)cc3)c3cc4c(cc3-c3cc5cc(-c6cccs6)sc5cc32)C(c2ccc(C)cc2)(c2ccc(C)cc2)c2cc3sc(-c5ccc(/C=C6\C(=O)c7ccccc7C6=C(C#N)C#N)s5)cc3cc2-4)cc1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 1/20 0.41
▸ RET P07949 1/20 0.41
▸ KDR P35968 1/20 0.41
▸ CTRC Q99895 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.32
▸ HPGD P15428 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ MAPT P10636 1/20 0.32
▸ THRB P10828 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ HTT P42858 1/20 0.31

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
SCHEMBL24637705 0.93 EGFR (0.36) EGFRRETKDRCTRC
SCHEMBL24637735 0.92 ALDH1A1 (0.32) EGFRRETKDRCTRCALDH1A1
SCHEMBL24637699 0.90 ALDH1A1 (0.32) EGFRRETKDRCTRCALDH1A1
SCHEMBL20042506 0.89 EGFR (0.39) EGFRRETKDRCTRC
SCHEMBL24637708 0.88 — —
SCHEMBL24637717 0.88 EGFR (0.40) EGFRRETKDRCTRCALDH1A1
SCHEMBL20040213 0.86 EGFR (0.39) EGFRRETKDRCTRC
SCHEMBL24637712 0.86 KMT2A (0.34) ALDH1A1HPGDKMT2AMAPTTHRB
SCHEMBL24637720 0.85 ALDH1A1 (0.30) ALDH1A1HPGDKMT2AMAPTTHRB
SCHEMBL24637731 0.85 EGFR (0.38) EGFRRETKDRCTRCALDH1A1

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