SCHEMBL26301092

SCHEMBL26301092

COc1ccc(C(=O)c2cc(-c3ccc(C(F)(F)F)cc3)c3cc(C(C)=O)ccn23)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN11 Q06124 2/20 0.42
▸ PTGDR2 Q9Y5Y4 1/20 0.42
▸ MAOB P27338 2/20 0.41
▸ CYP1A1 P04798 1/20 0.41
▸ CYP1B1 Q16678 1/20 0.41
▸ BAZ2B Q9UIF8 1/20 0.39
▸ BAZ2A Q9UIF9 1/20 0.39
▸ BACE1 P56817 2/20 0.39
▸ TP53 P04637 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ SYK P43405 3/20 0.39
▸ AURKB Q96GD4 1/20 0.39
▸ INCENP Q9NQS7 1/20 0.39
▸ ABCG2 Q9UNQ0 3/20 0.39
▸ SMARCA2 P51531 1/20 0.38
▸ SMARCA4 P51532 1/20 0.38
▸ BRD9 Q9H8M2 1/20 0.38
▸ TUBB4A P04350 1/20 0.38
▸ TUBB P07437 1/20 0.38

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
SCHEMBL26300929 1.00 PTPN11 (0.42) PTPN11PTGDR2MAOBCYP1A1CYP1B1
SCHEMBL26300877 0.92 CYP2C8 (0.43) MAOBBAZ2BBAZ2ABACE1
SCHEMBL26300894 0.91 CYP2C8 (0.42) MAOBBAZ2BBAZ2ABACE1
SCHEMBL26300657 0.91 PTGDR2 (0.43) PTPN11PTGDR2MAOBBAZ2BBAZ2A
SCHEMBL26300627 0.90 PTGDR2 (0.47) PTPN11PTGDR2MAOBCYP1A1CYP1B1
SCHEMBL26300425 0.90 PTGDR2 (0.47) PTPN11PTGDR2MAOBCYP1A1CYP1B1
SCHEMBL26300717 0.88 PTGDR2 (0.46) PTPN11PTGDR2MAOBCYP1A1CYP1B1
SCHEMBL26300978 0.87 BACE1 (0.47) MAOBBAZ2BBAZ2ABACE1
SCHEMBL26301174 0.87 ALDH1A1 (0.42) BAZ2BBAZ2ABACE1TP53SYK
SCHEMBL26300911 0.87 BACE1 (0.47) MAOBBAZ2BBAZ2ABACE1POLB

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-4233864-A1 INTERFERON GENE STIMULATOR COMPOSITION COMPRISING INDOLIZINE DERIVATIVE AS ACTIVE INGREDIENT Ajou University Industry-Academic Cooperation Foundation (KR) 2023-08-30 — — EP disclosed
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