SCHEMBL3847481

SCHEMBL3847481

Fc1ccc(-c2nn(C(c3ccccc3)(c3ccccc3)c3ccccc3)cc2-c2ccc3ncc(-c4ccccn4)n3c2)cc1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 12/20 0.40
TGFBR2 P37173 4/20 0.39
CSNK1D P48730 5/20 0.38
CSNK1E P49674 5/20 0.38
FLT3 P36888 2/20 0.37
MAPK14 Q16539 1/20 0.35
FYN P06241 1/20 0.34

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
SCHEMBL3848179 0.91 FLT3 (0.45) TGFBR1TGFBR2CSNK1DCSNK1EFLT3
SCHEMBL3846170 0.91 TGFBR1 (0.46) TGFBR1TGFBR2
SCHEMBL3852272 0.90 TGFBR1 (0.41) TGFBR1TGFBR2FYN
SCHEMBL3855867 0.90 TGFBR1 (0.40) TGFBR1TGFBR2
SCHEMBL3846843 0.90 TGFBR1 (0.41) TGFBR1TGFBR2
SCHEMBL3845245 0.90 FLT3 (0.39) TGFBR1TGFBR2CSNK1DCSNK1EFLT3
SCHEMBL3846055 0.90 TGFBR1 (0.42) TGFBR1TGFBR2
SCHEMBL3850099 0.89 TGFBR1 (0.39) TGFBR1TGFBR2
SCHEMBL3854925 0.88 TGFBR1 (0.39) TGFBR1TGFBR2
SCHEMBL4712454 0.88 TGFBR1 (0.39) TGFBR1TGFBR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2048142-A2 Nitrogen-containing condensed cyclic compound having a pyrazolyl group as a substituent group and pharmaceutical composition thereof Eisai R&D Management Co., Ltd. (JP) 2009-04-15 EP disclosed
EP-1382603-B1 NITROGENOUS FUSED-RING COMPOUND HAVING PYRAZOLYL GROUP AS SUBSTITUENT AND MEDICINAL COMPOSITION THEREOF EISAI R&D MAN CO LTD (JP) 2008-07-23 EP disclosed
US-7084100-B2 Antioxidant compositions THE PROCTER & GAMBLE COMPANY (US) 2006-08-01 US disclosed
US-7074801-B1 Nitrogen-containing condensed cyclic compound having a pyrazolyl group as a substituent group and pharmaceutical composition thereof EISAI CO., LTD. (JP) 2006-07-11 US disclosed
EP-1382603-A1 NITROGENOUS FUSED−RING COMPOUND HAVING PYRAZOLYL GROUP AS SUBSTITUENT AND MEDICINAL COMPOSITION THEREOF Eisai Co., Ltd. (JP) 2004-01-21 EP disclosed