SCHEMBL26300324

SCHEMBL26300324

O=C(c1ccc(C(F)(F)F)cc1)c1cc(-c2ccc(C(F)(F)F)cc2)c2cc(C(F)(F)F)ccn12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2C8 P10632 1/20 0.47
▸ SRD5A2 P31213 3/20 0.43
▸ CES2 O00748 1/20 0.40
▸ CES1 P23141 1/20 0.40
▸ KDM1A O60341 1/20 0.39
▸ BACE1 P56817 1/20 0.39
▸ MAP4K4 O95819 1/20 0.39
▸ SCN5A Q14524 3/20 0.38
▸ SCN9A Q15858 3/20 0.38
▸ PSEN1 P49768 1/20 0.38
▸ PSEN2 P49810 1/20 0.38
▸ APH1B Q8WW43 1/20 0.38
▸ NCSTN Q92542 1/20 0.38
▸ APH1A Q96BI3 1/20 0.38
▸ PSENEN Q9NZ42 1/20 0.38
▸ APP P05067 1/20 0.37
▸ RXRA P19793 1/20 0.37
▸ RXRB P28702 1/20 0.37
▸ RXRG P48443 1/20 0.37
▸ ESR1 P03372 1/20 0.36

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
SCHEMBL26300363 0.94 CYP2C8 (0.42) CYP2C8SRD5A2CES2CES1KDM1A
SCHEMBL26300393 0.94 BACE1 (0.45) CYP2C8SRD5A2BACE1FNTAFNTB
SCHEMBL26300513 0.94 BACE1 (0.45) CYP2C8SRD5A2BACE1PSEN1PSEN2
SCHEMBL26300425 0.91 PTGDR2 (0.47) CYP2C8
SCHEMBL26300627 0.91 PTGDR2 (0.47) CYP2C8
SCHEMBL26300469 0.91 BAZ2B (0.48) CYP2C8SRD5A2KDM1ABACE1SCN5A
SCHEMBL26300379 0.90 AKR1C3 (0.41) CYP2C8SRD5A2CES2CES1KDM1A
SCHEMBL26300565 0.88 FNTA (0.47) SRD5A2CES2BACE1FNTAFNTB
SCHEMBL26300717 0.88 PTGDR2 (0.46) BACE1
SCHEMBL26301296 0.86 FNTA (0.51) CYP2C8SRD5A2BACE1FNTAFNTB

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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