SCHEMBL25720270

SCHEMBL25720270

Cc1ccc2c(c1)Cc1cccc(SF)c1-2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.40
ALDH1A1 P00352 3/20 0.40
MAPT P10636 3/20 0.40
RAB9A P51151 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40
PKM P14618 1/20 0.40
METAP1 P53582 2/20 0.38
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
HPGD P15428 2/20 0.33
HTT P42858 1/20 0.33
ATM Q13315 1/20 0.33
PGR P06401 1/20 0.33
PDK2 Q15119 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32

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
SCHEMBL25720357 0.81 ALDH1A1 (0.36) KDM4EALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL21694429 0.78 MAPT (0.45) KDM4EALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL25836308 0.78 RAB9A (0.40) KDM4EALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL4897556 0.71 METAP1 (0.57) KDM4EALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL29633547 0.71 METAP1 (0.57) KDM4EALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL31400232 0.70 ALDH1A1 (0.59) KDM4EALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL1609497 0.70 ALDH1A1 (0.59) KDM4EALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL22889028 0.68 METAP1 (0.43) KDM4EALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL26461863 0.68 TDP2 (0.39) KDM4EALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL22539769 0.68 PGR (0.43) KDM4EALDH1A1MAPTRAB9ASMN1; SMN2

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-4190779-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME, AND COMPOSITION FOR ORGANIC LAYER OF ORGANIC LIGHT-EMITTING DEVICE LT Materials Co., Ltd. (KR) 2023-06-07 EP disclosed