SCHEMBL175901

SCHEMBL175901

CCCCCc1ccc2[nH]c(=O)oc2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 2/20 0.53
ALDH1A1 P00352 2/20 0.48
MEN1 O00255 1/20 0.48
MAPT P10636 1/20 0.48
KMT2A Q03164 1/20 0.48
IL4I1 Q96RQ9 1/20 0.47
CREBBP Q92793 1/20 0.44
KDM4E B2RXH2 1/20 0.44
PDE3B Q13370 1/20 0.43
PDE3A Q14432 1/20 0.43
PDE10A Q9Y233 1/20 0.43
TSHR P16473 1/20 0.42
OGT O15294 1/20 0.42
GPR84 Q9NQS5 1/20 0.42
ALPL P05186 1/20 0.41
NOS3 P29474 1/20 0.41
NOS2 P35228 1/20 0.41
CTSV O60911 1/20 0.41
CTSL P07711 1/20 0.41
PTGDR Q13258 1/20 0.41

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
SCHEMBL5491863 0.88 NOS1 (0.53) NOS1ALDH1A1MEN1MAPTKMT2A
SCHEMBL8786452 0.85 NOS1 (0.49) NOS1ALDH1A1IL4I1CREBBPKDM4E
SCHEMBL7408427 0.85 NOS1 (0.49) NOS1ALDH1A1MEN1MAPTKMT2A
SCHEMBL5536087 0.85 NOS1 (0.49) NOS1ALDH1A1IL4I1CREBBPKDM4E
SCHEMBL4891443 0.85 KDM4E (0.51) NOS1ALDH1A1MEN1MAPTKMT2A
SCHEMBL5536042 0.84 NOS1 (0.47) NOS1ALDH1A1MEN1MAPTKMT2A
SCHEMBL10392913 0.83 NOS1 (0.50) NOS1ALDH1A1IL4I1CREBBPKDM4E
SCHEMBL4675522 0.83 KDM4E (0.52) NOS1ALDH1A1MEN1MAPTKMT2A
SCHEMBL5535563 0.83 NOS1 (0.50) NOS1ALDH1A1IL4I1CREBBPKDM4E
SCHEMBL9463816 0.83 NOS1 (0.48) NOS1ALDH1A1MEN1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1998741-B1 SKIN LIGHTENING AGENTS, COMPOSITIONS AND METHODS UNILEVER PLC (GB) 2012-03-07 EP disclosed
EP-1998741-A1 SKIN LIGHTENING AGENTS, COMPOSITIONS AND METHODS UNILEVER PLC (GB) 2008-12-10 EP disclosed
CN-101255170-A 2,3-dihydroimidazo[2,1-b]oxazole compound OTSUKA PHARMA CO LTD (JP) 2008-09-03 CN disclosed
CN-101172981-A 2,3-dihydroimidazo[2,1-b]oxazole compound OTSUKA PHARMA CO LTD (JP) 2008-05-07 CN disclosed
WO-2007112854-A1 SKIN LIGHTENING AGENTS, COMPOSITIONS AND METHODS UNILEVER PLC (GB) 2007-10-11 WO disclosed
US-20070231282-A1 SKIN LIGHTENING AGENTS, COMPOSITIONS AND METHODS CONOPCO, INC., D/B/A UNILEVER 2007-10-04 US disclosed
US-7270805-B1 Skin lightening agents, compositions and methods CONOPCO, INC. (US) 2007-09-18 US disclosed
US-20070054899-A1 Aromatase inhibitor compounds and uses thereof PARALLEL WIRELESS, INC. 2007-03-08 US disclosed
EP-1678170-A1 USE OF A COMPOUND OF FORMULA (I) AS AN INHIBITOR OF AROMATASE FOR THERAPEUTIC PURPOSES AND COMPOUNDS OF FORMULA (1) THEREAS Yang Ji Chemical Company Ltd. (KR) 2006-07-12 EP disclosed
CN-1705670-A 2, 3-dihydro-6-nitroimidazo [2, 1-b ] oxazole compounds OTSUKA PHARMA CO LTD (JP) 2005-12-07 CN disclosed
WO-2005033104-A1 USE OF A COMPOUND OF FORMULA (I) AS AN INHIBITOR OF AROMATASE FOR THERAPEUTIC PURPOSES AND COMPOUNDS OF FORMULA (1) THEREAS YANG JI CHEMICAL COMPANY, LTD (KR) 2005-04-14 WO disclosed
US-4778792-A Use of 7-acyl benzoxazinones and their derivatives in treating atheromatous disorders LABORATORIES NEGMA (FR) 1988-10-18 US 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-20070054899-A1 Aromatase inhibitor compounds and uses thereof CYP19A1, CYP17A1, HSD17B11 NOS1 418/4885ALDH1A1 207/4885MEN1 1149/4885
US-20070231282-A1 SKIN LIGHTENING AGENTS, COMPOSITIONS AND METHODS CUTA, TYR, MCOLN1 NOS1 2290/4885ALDH1A1 99/4885MEN1 1988/4885

“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.