SCHEMBL2920544

SCHEMBL2920544

c1ccc(-c2ccccc2-c2ccccc2)cc1.c1ccc(-c2ccccc2-c2ccccc2)cc1.c1ccc(-c2ccccc2-c2ccccc2)cc1.c1cnnnc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 1/20 0.45
ALDH1A1 P00352 6/20 0.44
HSD17B10 Q99714 2/20 0.44
HPGD P15428 1/20 0.44
BCL2L1 Q07817 1/20 0.44
CYP2A6 P11509 1/20 0.44
MAPK1 P28482 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
GPR55 Q9Y2T6 1/20 0.42
NOTUM Q6P988 1/20 0.42
DCUN1D1 Q96GG9 2/20 0.41
TNF P01375 1/20 0.41
BACE1 P56817 1/20 0.40
TDO2 P48775 1/20 0.40
PTGS2 P35354 1/20 0.40
MAPT P10636 1/20 0.40
TSHR P16473 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
DPP4 P27487 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
SCHEMBL16294953 1.00 NISCH (0.45) NISCHALDH1A1HSD17B10HPGDBCL2L1
SCHEMBL28023682 0.87 ALDH1A1 (0.54) NISCHALDH1A1HPGDMAPK1NPSR1
Biphenyl SCHEMBL790630 0.86 ALDH1A1 (0.56) NISCHALDH1A1HSD17B10BCL2L1MAPK1
Biphenyl SCHEMBL418438 0.86 ALDH1A1 (0.56) NISCHALDH1A1HSD17B10BCL2L1MAPK1
Biphenyl SCHEMBL790623 0.86 ALDH1A1 (0.56) NISCHALDH1A1HSD17B10BCL2L1MAPK1
SCHEMBL18989242 0.84 CYP2A6 (0.71) ALDH1A1HPGDCYP2A6NOTUMPTGS2
2-Phenylphenol SCHEMBL28165069 0.84 HPGD (0.71) ALDH1A1HSD17B10HPGDBCL2L1NPSR1
SCHEMBL29177893 0.83 LMNA (0.37) NISCHALDH1A1HSD17B10HPGDBCL2L1
SCHEMBL29211947 0.82 GPR55 (0.45) NISCHALDH1A1HSD17B10HPGDBCL2L1
SCHEMBL21447 0.80 ALDH1A1 (0.61) NISCHALDH1A1HSD17B10HPGDBCL2L1

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
US-8404705-B2 Naphthalene amidine imides BASF SE (DE) 2013-03-26 US disclosed
EP-1907484-B1 NAPHTHALENE AMIDINE IMIDES BASF SE (DE) 2010-09-29 EP disclosed
US-20100202984-A1 Naphthalene amidine imides BASF SE (DE) 2010-08-12 US disclosed
EP-1907484-A1 NAPHTHALENE AMIDINE IMIDES Ciba Specialty Chemicals Holding, Inc. (CH) 2008-04-09 EP disclosed
WO-2007012611-A1 NAPHTHALENE AMIDINE IMIDES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2007-02-01 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100202984-A1 Naphthalene amidine imides NES, TXN2, NAT1 NISCH 1556/4885ALDH1A1 1047/4885HSD17B10 3061/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.