SCHEMBL26477255

SCHEMBL26477255

O=c1cc[nH]c2c(C(F)(F)F)cccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 1.00
SMN1; SMN2 Q16637 3/20 1.00
HSD17B10 Q99714 2/20 1.00
KMT2A Q03164 2/20 0.57
MEN1 O00255 1/20 0.57
ALDH1A1 P00352 1/20 0.57
LMNA P02545 1/20 0.57
POLB P06746 1/20 0.57
HPGD P15428 1/20 0.57
HTT P42858 1/20 0.57
CCR8 P51685 1/20 0.53
KIF11 P52732 1/20 0.46
PARP1 P09874 1/20 0.45
PIM1 P11309 1/20 0.42
PIM3 Q86V86 1/20 0.42
C1R P00736 1/20 0.38
CES1 P23141 1/20 0.38
TRPV1 Q8NER1 1/20 0.35
PLA2G7 Q13093 1/20 0.35

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
SCHEMBL6224301 0.76 HSD17B10 (0.61) KDM4ESMN1; SMN2HSD17B10KMT2AMEN1
SCHEMBL23300924 0.76 KDM4E (0.61) KDM4ESMN1; SMN2HSD17B10KMT2AMEN1
SCHEMBL29933981 0.76 KDM4E (0.61) KDM4ESMN1; SMN2HSD17B10KMT2ACCR8
SCHEMBL15252375 0.76 KDM4E (0.61) KDM4ESMN1; SMN2HSD17B10KMT2ACCR8
SCHEMBL8130015 0.75 KDM4E (0.59) KDM4ESMN1; SMN2HSD17B10KMT2AMEN1
SCHEMBL8133180 0.74 KDM4E (0.59) KDM4ESMN1; SMN2HSD17B10KMT2AMEN1
SCHEMBL6363004 0.74 HSD17B10 (0.59) KDM4ESMN1; SMN2HSD17B10KMT2AMEN1
SCHEMBL6363005 0.74 HSD17B10 (0.59) KDM4ESMN1; SMN2HSD17B10KMT2AMEN1
SCHEMBL593971 0.73 KDM4E (0.58) KDM4ESMN1; SMN2HSD17B10KMT2AMEN1
SCHEMBL1245388 0.73 CCR8 (0.61) KDM4ESMN1; SMN2HSD17B10KMT2AALDH1A1

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
WO-2023072273-A1 POLYCYCLIC COMPOUND AS CBL-B INHIBITOR 先声再明医药有限公司 2023-05-04 WO disclosed