SCHEMBL7913562

SCHEMBL7913562

c1ccc2c(c1)ccc1c2nnc2ccc3ccccc3c21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 1/20 0.43
MAOA P21397 1/20 0.42
L3MBTL1 Q9Y468 3/20 0.41
RAB9A P51151 3/20 0.41
CYP3A4 P08684 2/20 0.41
TSHR P16473 2/20 0.41
HSD17B10 Q99714 2/20 0.41
HPGD P15428 1/20 0.41
MAPK1 P28482 1/20 0.41
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
ATM Q13315 1/20 0.41
HIF1A Q16665 1/20 0.41
TDP1 Q9NUW8 2/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP2A6 P11509 1/20 0.41
TYMS P04818 2/20 0.40
KDM4E B2RXH2 1/20 0.40
PRMT5 O14744 1/20 0.39
PRMT3 O60678 1/20 0.39

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
SCHEMBL15545385 0.83 HSD17B10 (0.52) HPRT1L3MBTL1RAB9ACYP3A4TSHR
SCHEMBL1869260 0.82 GPR3 (0.54) HPRT1L3MBTL1RAB9ACYP3A4TSHR
SCHEMBL5466728 0.81 HPRT1 (0.57) HPRT1MAOAL3MBTL1RAB9ACYP3A4
SCHEMBL5470832 0.72 PRMT5 (0.56) HPRT1MAOAL3MBTL1RAB9ACYP3A4
SCHEMBL1999097 0.71 HPRT1 (0.50) HPRT1MAOAL3MBTL1RAB9ACYP3A4
SCHEMBL18842483 0.71 HPRT1 (0.44) HPRT1MAOAL3MBTL1RAB9ACYP3A4
SCHEMBL5473804 0.70 PRMT5 (0.59) HPRT1MAOAL3MBTL1RAB9ACYP3A4
SCHEMBL3857012 0.69 TSHR (0.48) HPRT1MAOARAB9ACYP3A4TSHR
SCHEMBL159416 0.69 KDM4E (0.59) HPRT1L3MBTL1RAB9ACYP3A4TSHR
SCHEMBL21297766 0.69 HPRT1 (0.48) HPRT1L3MBTL1RAB9ACYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0872903-B1 Method for making hydrogen storage alloy powder and electrode comprising the alloy powder SHINETSU CHEMICAL CO (JP) 2001-10-04 EP disclosed
US-6277519-B1 QUENCHING AN ALLOY MELT; COMMINUTION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2001-08-21 US disclosed
US-6096144-A TREATING WITH ACIDIC OR ALKALINE SOLUTION OF CONJUGATED UNSATURATED COMPOUND WITH AT LEAST 5 BONDS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2000-08-01 US disclosed
US-5858571-A TREATING A PULVERIZED HYDROGEN ABSORBING ALLOY WITH A SOLUTION COMPRISING A CONJUGATED UNSATURATED COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 1999-01-12 US disclosed
EP-0872903-A1 Method for making hydrogen storage alloy powder and electrode comprising the alloy powder Shin-Etsu Chemical Co., Ltd. (JP) 1998-10-21 EP disclosed
US-4539230-A COATING WALLS WITH A CHELATE COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 1985-09-03 US disclosed
EP-0126991-A1 A method for preventing deposition of polymer scale and a coating agent therefor Shin-Etsu Chemical Co., Ltd. (JP) 1984-12-05 EP disclosed