SCHEMBL26300657

SCHEMBL26300657

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

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGDR2 Q9Y5Y4 1/20 0.43
▸ MAOB P27338 3/20 0.40
▸ BAZ2B Q9UIF8 2/20 0.40
▸ BAZ2A Q9UIF9 2/20 0.40
▸ BACE1 P56817 1/20 0.39
▸ PTPN11 Q06124 1/20 0.39
▸ TUBB4A P04350 1/20 0.39
▸ TUBB P07437 1/20 0.39
▸ TUBA3C P0DPH7 1/20 0.39
▸ TUBA1B P68363 1/20 0.39
▸ TUBA4A P68366 1/20 0.39
▸ TUBB4B P68371 1/20 0.39
▸ TUBB3 Q13509 1/20 0.39
▸ TUBB2A Q13885 1/20 0.39
▸ TUBB8 Q3ZCM7 1/20 0.39
▸ TUBA3E Q6PEY2 1/20 0.39
▸ TUBA1A Q71U36 1/20 0.39
▸ TUBA1C Q9BQE3 1/20 0.39
▸ TUBB6 Q9BUF5 1/20 0.39
▸ TUBB2B Q9BVA1 1/20 0.39

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
SCHEMBL26300717 0.96 PTGDR2 (0.46) PTGDR2MAOBBACE1PTPN11TUBB4A
SCHEMBL26300425 0.94 PTGDR2 (0.47) PTGDR2MAOBPTPN11TUBB4ATUBB
SCHEMBL26300627 0.94 PTGDR2 (0.47) PTGDR2MAOBPTPN11TUBB4ATUBB
SCHEMBL26300929 0.91 PTPN11 (0.42) PTGDR2MAOBBAZ2BBAZ2ABACE1
SCHEMBL26301092 0.91 PTPN11 (0.42) PTGDR2MAOBBAZ2BBAZ2ABACE1
SCHEMBL26300691 0.90 ALDH1A1 (0.46) PTGDR2MAOBBAZ2BBAZ2ABACE1
SCHEMBL26300580 0.90 PTGDR2 (0.46) PTGDR2MAOBBAZ2BBAZ2ABACE1
SCHEMBL26300363 0.90 CYP2C8 (0.42) MAOBBAZ2BBAZ2ABACE1
SCHEMBL26301954 0.89 BAZ2B (0.49) PTGDR2MAOBBAZ2BBAZ2ABACE1
SCHEMBL26300545 0.88 FNTA (0.44) MAOBBAZ2BBAZ2ABACE1MAPT

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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