SCHEMBL6077149

SCHEMBL6077149

CCCCCc1ccc2nc(C)c(C)c(O)c2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 2/20 0.48
DHODH Q02127 1/20 0.44
KAT8 Q9H7Z6 2/20 0.43
PPARA Q07869 1/20 0.43
ESR1 P03372 2/20 0.42
ADRA2A P08913 2/20 0.42
ADORA3 P0DMS8 2/20 0.42
TACR2 P21452 2/20 0.42
SLC6A2 P23975 2/20 0.42
SLC6A4 P31645 2/20 0.42
SLC6A3 Q01959 2/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
SHBG P04278 1/20 0.42
TP53 P04637 1/20 0.42
CYP3A4 P08684 1/20 0.42
HSPD1 P10809 1/20 0.42
ADRB3 P13945 1/20 0.42
HTR2C P28335 1/20 0.42

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
SCHEMBL19478673 0.80 PSMB5 (0.52) PSMB5ESR1ADRA2AADORA3TACR2
SCHEMBL23574176 0.79 DHODH (0.56) PSMB5DHODHKAT8PPARAALDH1A1
SCHEMBL6077005 0.78 DHODH (0.43) PSMB5DHODHKAT8PPARAALDH1A1
SCHEMBL3397263 0.77 TLR8 (0.47) KAT8PPARAESR1ADRA2AADORA3
SCHEMBL9252756 0.75 ACHE (0.51) ALDH1A1TP53ACHE
SCHEMBL23130637 0.75 PSMB5 (0.57) PSMB5LMNATP53HIF1ATLR8
SCHEMBL13107066 0.73 KDM4E (0.49) PSMB5DHODHKDM4EALDH1A1LMNA
SCHEMBL15075230 0.72 PSMB5 (0.46) PSMB5DHODHLMNATP53HIF1A
SCHEMBL5398097 0.72 TLR8 (0.53) TLR8
SCHEMBL7059976 0.72 KDM4E (0.68) PSMB5DHODHKDM4ECYP3A4HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7067668-B2 4-quinolinol derivatives and fungicides containing the same as an active ingredient used for agriculture and horticulture MEIJI SEIKA KAISHA, LTD. (JP) 2006-06-27 US disclosed
EP-0990648-B1 4-QUINOLINOL DERIVATIVES AND AGROHORTICULTURAL BACTERICIDES CONTAINING THE SAME AS ACTIVE INGREDIENT MEIJI SEIKA KAISHA (JP) 2005-11-02 EP disclosed
CN-1169794-C 4-quinolinol derivatives and agrohorticultural bactericides containing the same as active ingredient �����Ƹ���ʽ���� 2004-10-06 CN disclosed
US-20040152728-A1 4-Quinolinol derivatives and fungicides containing the same as an active ingredient used for agriculture and horticulture MEIJI SEIKA KAISHA, LTD. (JP) 2004-08-05 US disclosed
US-6680282-B2 FUNGICIDE HAVING AN EXCELLENT CONTROL EFFECT; 4-QUINOLINOL DERIVATIVES HAVING SPECIFIC SUBSTITUENT AT 1,2 AND ATLEAST ONE SUBSTITUENT AT 5,6,7,8 POSITION MEIJI SEIKA KAISHA, LTD. (JP) 2004-01-20 US disclosed
US-20030119863-A1 4-Quinolinol derivatives and agrohorticultural bactericides containing the same as active ingredient MEIJI SEIKA PHARMA CO., LTD. (JP) 2003-06-26 US disclosed
CN-1259124-A 4-quinolyl phenol derivatives and agricultural and horticultural fungicides containing the same as the active ingredient RHONE POULENC YUKA AGRO KABUSH (JP) 2000-07-05 CN disclosed
EP-0990648-A1 4-QUINOLINOL DERIVATIVES AND AGROHORTICULTURAL BACTERICIDES CONTAINING THE SAME AS ACTIVE INGREDIENT Meiji Seika Kaisha, Ltd. (JP) 2000-04-05 EP 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 (2 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-20040152728-A1 4-Quinolinol derivatives and fungicides containing the same as an active ingredient used for agriculture and horticulture CYP51A1, CYP4X1, CYP4Z1 PSMB5 2425/4885DHODH 115/4885KAT8 2470/4885
US-20030119863-A1 4-Quinolinol derivatives and agrohorticultural bactericides containing the same as active ingredient CYP51A1, DDT, PGLS PSMB5 2558/4885DHODH 41/4885KAT8 3208/4885

“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.