SCHEMBL2930004

SCHEMBL2930004

NC(c1cccc(Cl)c1)c1ccc(CN2CCCC2)c(Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.48
ALDH1A1 P00352 2/20 0.48
POLB P06746 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
SIGMAR1 Q99720 3/20 0.48
CYP2A13 Q16696 1/20 0.46
CHKA P35790 1/20 0.41
MAPT P10636 1/20 0.39
OPRM1 P35372 2/20 0.39
OPRD1 P41143 2/20 0.39
OPRK1 P41145 2/20 0.39
OPRL1 P41146 2/20 0.39
CXCR4 P61073 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 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
SCHEMBL2923318 0.89 CYP2A13 (0.63) KDM4EALDH1A1SIGMAR1CYP2A13
SCHEMBL2926469 0.85 ALDH1A1 (0.50) KDM4EALDH1A1POLBSIGMAR1
SCHEMBL24508364 0.76 KDM4E (0.73) KDM4EALDH1A1POLBTDP1SIGMAR1
SCHEMBL30596611 0.75 KDM4E (0.71) KDM4EALDH1A1POLBTDP1SIGMAR1
SCHEMBL2927630 0.75 KDM4E (0.52) KDM4EALDH1A1POLBTDP1MEN1
SCHEMBL2931423 0.74 PDE4B (0.50) ALDH1A1SIGMAR1CYP2A13MEN1KMT2A
Ammonia Solution, Strong SCHEMBL2930007 0.73 SIGMAR1 (0.57) KDM4EALDH1A1POLBTDP1SIGMAR1
SCHEMBL2928148 0.73 APP (0.54) MEN1KMT2A
SCHEMBL8276926 0.73 SLC6A2 (0.49) MAPTOPRM1OPRD1OPRK1OPRL1
SCHEMBL8278910 0.73 SLC6A2 (0.49) MAPTOPRM1OPRD1OPRK1OPRL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2121616-B1 NOVEL 4-AMINO-QUINOLINE DERIVATIVES USEFUL AS ANTI-MALARIA DRUGS CAMPIANI GIUSEPPE (IT) 2010-09-15 EP disclosed
US-20100093726-A1 NOVEL 4-AMINO-QUINOLINE DERIVATIVES USEFUL AS ANTI-MALARIA DRUGS GIUSEPPE CAMPIANI (IT) 2010-04-15 US disclosed
EP-2121616-A1 NOVEL 4-AMINO-QUINOLINE DERIVATIVES USEFUL AS ANTI-MALARIA DRUGS Campiani, Giuseppe (IT) 2009-11-25 EP disclosed
WO-2008101891-A1 NOVEL 4-AMINO-QUINOLINE DERIVATIVES USEFUL AS ANTI-MALARIA DRUGS CAMPIANI GIUSEPPE (IT) 2008-08-28 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-20100093726-A1 NOVEL 4-AMINO-QUINOLINE DERIVATIVES USEFUL AS ANTI-MALARIA DRUGS QTRT1, QTRT2, IL4I1 KDM4E 315/4885ALDH1A1 4027/4885POLB 2462/4885

“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.