SCHEMBL8990319

SCHEMBL8990319

c1ccc2c(c1)N2c1cccc2ccccc12

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.63
ELANE P08246 1/20 0.53
ALDH1A1 P00352 7/20 0.50
HSD17B10 Q99714 4/20 0.50
HPGD P15428 3/20 0.50
TSHR P16473 3/20 0.50
CYP1A2 P05177 3/20 0.50
MAPT P10636 2/20 0.50
MAPK1 P28482 2/20 0.50
PKM P14618 1/20 0.50
NPC1 O15118 1/20 0.50
HTR3E A5X5Y0 1/20 0.50
HTR3B O95264 1/20 0.50
HTR1A P08908 1/20 0.50
CYP2D6 P10635 1/20 0.50
NCF1 P14598 1/20 0.50
NFKB1 P19838 1/20 0.50
HTR1D P28221 1/20 0.50
HTR1B P28222 1/20 0.50
HTR2A P28223 1/20 0.50

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
SCHEMBL30285929 1.00 POLB (0.63) POLBELANEALDH1A1HSD17B10HPGD
SCHEMBL18770820 1.00 POLB (0.63) POLBELANEALDH1A1HSD17B10HPGD
SCHEMBL19343021 0.92 POLB (0.61) POLBELANEALDH1A1HSD17B10HPGD
SCHEMBL13296020 0.89 POLB (0.53) POLBELANEALDH1A1HSD17B10HPGD
SCHEMBL17794545 0.86 POLB (0.55) POLBELANEALDH1A1HSD17B10HPGD
SCHEMBL24434125 0.84 POLB (0.53) POLBELANEALDH1A1HSD17B10HPGD
SCHEMBL13425438 0.84 POLB (0.49) POLBELANEALDH1A1HSD17B10HPGD
SCHEMBL10941014 0.83 POLB (0.52) POLBELANEALDH1A1HSD17B10HPGD
SCHEMBL30867065 0.83 POLB (0.52) POLBELANEALDH1A1HSD17B10HPGD
SCHEMBL30286094 0.83 BCHE (0.54) POLBELANEALDH1A1HSD17B10HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0374813-B1 Magnetic recording medium BASF AG (DE) 1996-07-24 EP disclosed
US-5075179-A Stabilized binder gives waterproofing, oxidation resistance BASF AKTIENGESELLSCHAFT (DE) 1991-12-24 US disclosed
EP-0374813-A2 Magnetic recording medium BASF Aktiengesellschaft (DE) 1990-06-27 EP disclosed