SCHEMBL5138445

SCHEMBL5138445

C=C1C(F)=C(c2ccccc2)c2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.38
HSD17B10 Q99714 2/20 0.38
FGFR1 P11362 4/20 0.37
FGFR2 P21802 4/20 0.37
FGFR4 P22455 4/20 0.37
FGFR3 P22607 4/20 0.37
CDC25A P30304 1/20 0.36
CDC25B P30305 1/20 0.36
SRC P12931 2/20 0.35
CRHBP P24387 1/20 0.35
CRHR2 Q13324 1/20 0.35
P2RX7 Q99572 1/20 0.34
MAPT P10636 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
MAPK1 P28482 2/20 0.33
HPGD P15428 1/20 0.33
BCL2L1 Q07817 1/20 0.33
CYP2A6 P11509 1/20 0.33
MITF O75030 1/20 0.33
HTT P42858 1/20 0.33

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
SCHEMBL29108688 0.79 FGFR1 (0.41) ALDH1A1HSD17B10FGFR1FGFR2FGFR4
SCHEMBL5138330 0.74 CYP2A6 (0.43) ALDH1A1HSD17B10FGFR1FGFR2FGFR4
SCHEMBL5138507 0.74 ALDH1A1 (0.43) ALDH1A1HSD17B10FGFR1FGFR2FGFR4
SCHEMBL5138007 0.74 CDC25A (0.40) ALDH1A1HSD17B10FGFR1FGFR2FGFR4
Hydrochloric Acid SCHEMBL7938606 0.71 FGFR1 (0.35) ALDH1A1HSD17B10FGFR1FGFR2FGFR4
SCHEMBL19879495 0.70 ALDH1A1 (0.50) ALDH1A1HSD17B10FGFR1FGFR2FGFR4
SCHEMBL5138388 0.69 FGFR1 (0.65) ALDH1A1FGFR1FGFR2FGFR4FGFR3
SCHEMBL5138106 0.69 MEN1 (0.39) ALDH1A1FGFR1FGFR2FGFR4FGFR3
SCHEMBL7023237 0.68 ALDH1A1 (0.47) ALDH1A1HSD17B10FGFR1FGFR2FGFR4
SCHEMBL14401541 0.66 ALDH1A1 (0.44) ALDH1A1HSD17B10FGFR1FGFR2FGFR4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008037604-A1 NOVEL POLYBENZOFULVENE DERIVATIVES, SYNTHESIS AND USES THEREOF UNIVERSITÀ DEGLI STUDI DI SIENA (IT) 2008-04-03 WO claimed
WO-2008037604-A1 NOVEL POLYBENZOFULVENE DERIVATIVES, SYNTHESIS AND USES THEREOF UNIVERSITÀ DEGLI STUDI DI SIENA (IT) 2008-04-03 WO disclosed