SCHEMBL8088802

SCHEMBL8088802

CCCC(c1ncc[nH]1)c1ncc[nH]1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 2/20 0.43
F2RL1 P55085 10/20 0.41
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP19A1 P11511 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
ALDH1A1 P00352 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TXN P10599 1/20 0.37
TXNRD1 Q16881 1/20 0.37
MTOR P42345 1/20 0.36
ADK P55263 1/20 0.36
NISCH Q9Y2I1 1/20 0.36
ADRA2A P08913 2/20 0.36
ADRA2B P18089 2/20 0.36
ADRA2C P18825 2/20 0.36

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
SCHEMBL19642925 0.88 CYP1A2 (0.44) FPR2F2RL1CYP1A2CYP3A4CYP2D6
SCHEMBL14880753 0.86 CYP1A2 (0.42) FPR2F2RL1CYP1A2CYP3A4CYP2D6
SCHEMBL953334 0.86 CHRM2 (0.43) FPR2F2RL1MTORADKNISCH
SCHEMBL28363270 0.85 CYP1A2 (0.41) FPR2F2RL1CYP1A2CYP3A4CYP2D6
SCHEMBL3588499 0.83 FPR2 (0.43) FPR2F2RL1CYP1A2CYP3A4CYP2D6
SCHEMBL28569899 0.82 FPR2 (0.36) FPR2F2RL1CYP1A2CYP3A4CYP2D6
SCHEMBL8540931 0.82 FPR2 (0.42) FPR2F2RL1CYP1A2CYP3A4CYP2D6
Hydrochloric Acid SCHEMBL29248987 0.81 TXN (0.42) FPR2F2RL1CYP1A2CYP3A4CYP2D6
SCHEMBL3030811 0.80 FPR2 (0.41) FPR2F2RL1CYP1A2CYP3A4CYP2D6
SCHEMBL7269219 0.80 FPR2 (0.47) FPR2F2RL1CYP1A2CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2820105-A1 ADDITIVES FOR DYE-SENSITIZED SOLAR CELLS Merck Patent GmbH (DE) 2015-01-07 EP disclosed
EP-2734289-A2 METHOD AND MEMBRANE FOR NANOPOROUS, BICONTINUOUS CUBIC LYOTROPIC LIQUID CRYSTAL POLYMER MEMBRANES THAT ENABLE FACILE FILM PROCESSING AND PORE SIZE CONTROL The Regents of the University of Colorado, a body corporate (US) 2014-05-28 EP disclosed
WO-2013058851-A2 METHOD AND MEMBRANE FOR NANOPOROUS, BICONTINUOUS CUBIC LYOTROPIC LIQUID CRYSTAL POLYMER MEMBRANES THAT ENABLE FACILE FILM PROCESSING AND PORE SIZE CONTROL THE REGENTS OF THE UNIVERSITY OF COLORADO (US) 2013-04-25 WO disclosed
WO-2013026563-A1 ADDITIVES FOR DYE-SENSITIZED SOLAR CELLS MERCK PATENT GMBH (DE) 2013-02-28 WO disclosed
EP-1051144-A1 USE OF HETEROCYCLIC QUATERNARY POLYAMMONIUM POLYMERS AS PROTECTIVE AGENT FOR KERATIN FIBRES AND COSMETIC COMPOSITIONS L'OREAL (FR) 2000-11-15 EP disclosed
WO-1999037276-A1 USE OF HETEROCYCLIC QUATERNARY POLYAMMONIUM POLYMERS AS PROTECTIVE AGENT FOR KERATIN FIBRES AND COSMETIC COMPOSITIONS L'OREAL (FR) 1999-07-29 WO disclosed