SCHEMBL9260414

SCHEMBL9260414

c1ccc2c(c1)nc1ccc3ccnoc3c12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 1/20 0.42
CCND1 P24385 1/20 0.42
KDM4E B2RXH2 6/20 0.37
ALDH1A1 P00352 6/20 0.37
HPGD P15428 4/20 0.37
GLA P06280 3/20 0.37
MAOA P21397 2/20 0.37
CASP1 P29466 2/20 0.37
CASP7 P55210 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
HSD17B10 Q99714 2/20 0.37
CHRM2 P08172 1/20 0.37
ADRA2A P08913 1/20 0.37
ADORA3 P0DMS8 1/20 0.37
CHRM1 P11229 1/20 0.37
NQO2 P16083 1/20 0.37
DRD1 P21728 1/20 0.37
ACHE P22303 1/20 0.37
SLC6A2 P23975 1/20 0.37
ADRA1A P35348 1/20 0.37

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
SCHEMBL1859838 0.76 CDK4 (0.39) CDK4CCND1KDM4EALDH1A1HPGD
SCHEMBL4501936 0.75 CDK4 (0.43) CDK4CCND1KDM4EALDH1A1HPGD
SCHEMBL29089487 0.70 CDK4 (0.42) CDK4CCND1KDM4EALDH1A1HPGD
SCHEMBL1202590 0.69 CDK4 (0.41) CDK4CCND1KDM4EALDH1A1HPGD
SCHEMBL420380 0.69 CDK4 (0.54) CDK4CCND1KDM4EALDH1A1HPGD
SCHEMBL3888976 0.68 CYP3A4 (0.37) KDM4EALDH1A1MAPTKMT2ARAD52
SCHEMBL8132839 0.67 ESR1 (0.40) KDM4EALDH1A1HPGDGLAMAOA
SCHEMBL60730 0.66 LMNA (0.55) CDK4CCND1KDM4EALDH1A1HPGD
SCHEMBL5476684 0.65 KDM4E (0.52) CDK4CCND1KDM4EALDH1A1HPGD
SCHEMBL10944923 0.65 ALDH1A1 (0.61) CDK4CCND1KDM4EALDH1A1HPGD

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0037784-B1 INDOLOBENZOXAZINE DERIVATIVES, THEIR SALTS, PROCESS FOR THEIR PREPARATION, THEIR USE AS MEDICAMENTS AND COMPOSITIONS CONTAINING THEM ROUSSEL-UCLAF (FR) 1984-08-01 EP claimed
US-4318910-A Indolobenzoxazines ROUSSEL UCLAF (FR) 1982-03-09 US claimed
JP-6287193-A None JP disclosed
US-5466689-A Analgesics TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1995-11-14 US disclosed
JP-H06287193-A CONDENSED MORPHOLINE DERIVATIVE TAKEDA CHEM IND LTD 1994-10-11 JP disclosed
EP-0610793-A1 Tetracyclic morpholine derivatives and their use or analgesics Takeda Chemical Industries, Ltd. (JP) 1994-08-17 EP disclosed
US-4503053-A HYPOTENSIVE, DOPAMINERGIC AGONIST, ANTIANOXIC, PROLACTIN SECRETION INHIBITION ROUSSEL UCLAF (FR) 1985-03-05 US disclosed
US-4493836-A HYPOTENSIVE, ANTISEROTONINE AGENTS, DOPAMINE ANTAGONIST Uclaf, Roussel (FR) 1985-01-15 US disclosed
EP-0033767-B1 INDOLOBENZOXAZINES, PROCESSES FOR PREPARING AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME MERCK & CO. INC. (US) 1984-06-27 EP disclosed
EP-0033767-B1 INDOLOBENZOXAZINES, PROCESSES FOR PREPARING AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME MERCK & CO. INC. (US) 1984-06-27 EP disclosed
US-4420480-A PARKINSONISM, DEPRESSION, HYPOTENSIVES MERCK & CO., INC. (US) 1983-12-13 US disclosed
US-4318910-A Indolobenzoxazines ROUSSEL UCLAF (FR) 1982-03-09 US disclosed
US-4318910-A Indolobenzoxazines ROUSSEL UCLAF (FR) 1982-03-09 US disclosed
EP-0037784-A1 Indolobenzoxazine derivatives, their salts, process for their preparation, their use as medicaments and compositions containing them ROUSSEL-UCLAF (FR) 1981-10-14 EP disclosed
EP-0033767-A1 Indolobenzoxazines, processes for preparing and pharmaceutical compositions containing the same MERCK & CO. INC. (US) 1981-08-19 EP disclosed
EP-0033767-A1 Indolobenzoxazines, processes for preparing and pharmaceutical compositions containing the same MERCK & CO. INC. (US) 1981-08-19 EP disclosed
EP-0033767-A1 Indolobenzoxazines, processes for preparing and pharmaceutical compositions containing the same MERCK & CO. INC. (US) 1981-08-19 EP disclosed
US-4238486-A TREATING HYPERTENSION AND PARKINSON*S DISEASE MERCK & CO., INC. (US) 1980-12-09 US disclosed
US-4238486-A TREATING HYPERTENSION AND PARKINSON*S DISEASE MERCK & CO., INC. (US) 1980-12-09 US disclosed
US-4238486-A TREATING HYPERTENSION AND PARKINSON*S DISEASE MERCK & CO., INC. (US) 1980-12-09 US disclosed