SCHEMBL433000

SCHEMBL433000

CCCCCCCCCCCCCCCCC(=O)Oc1cc2oc(-c3ccccc3)cc(=O)c2c(O)c1OC

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CREB1 P16220 3/20 0.60
FLT3 P36888 2/20 0.60
SLCO2B1 O94956 1/20 0.60
PRSS1 P07477 1/20 0.60
PRSS2 P07478 1/20 0.60
PRSS3 P35030 1/20 0.60
PTPRS Q13332 1/20 0.58
ABCB1 P08183 2/20 0.56
KDM4E B2RXH2 1/20 0.56
POLB P06746 1/20 0.56
ADORA3 P0DMS8 1/20 0.56
MAPT P10636 1/20 0.56
ABCG2 Q9UNQ0 1/20 0.56

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
SCHEMBL12978377 0.96 CREB1 (0.62) CREB1FLT3SLCO2B1PRSS1PRSS2
SCHEMBL12792821 0.84 ABCB1 (0.66) CREB1ABCB1KDM4EPOLBABCG2
Mosloflavone SCHEMBL29477310 0.81 KDM4E (0.81) CREB1FLT3SLCO2B1PRSS1PRSS2
Mosloflavone SCHEMBL971985 0.81 KDM4E (0.81) CREB1FLT3SLCO2B1PRSS1PRSS2
SCHEMBL971876 0.80 CREB1 (0.71) CREB1ABCB1
SCHEMBL973259 0.80 CREB1 (0.71) CREB1ABCB1
SCHEMBL7608398 0.79 CREB1 (0.68) CREB1FLT3SLCO2B1PRSS1PRSS2
SCHEMBL973080 0.79 CREB1 (0.72) CREB1FLT3SLCO2B1PRSS1PRSS2
SCHEMBL30577296 0.78 CREB1 (0.69) CREB1FLT3SLCO2B1PRSS1PRSS2
SCHEMBL29074013 0.78 CREB1 (0.69) CREB1FLT3SLCO2B1PRSS1PRSS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9642854-B2 Flavanoid compounds and process for preparation thereof COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2017-05-09 US disclosed
US-20150174135-A1 FLAVANOID COMPOUNDS AND PROCESS FOR PREPARATION THEREOF COUNCIL SCIENT IND RES (IN) 2015-06-25 US disclosed
US-8969384-B2 Flavonoid compounds and process for preparation thereof COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2015-03-03 US disclosed
US-20120022062-A1 Flavanoid Compounds and Process for Preparation Thereof COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2012-01-26 US disclosed
US-20110059913-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF GASTROINTESTINAL INDICATIONS COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2011-03-10 US disclosed
US-7855200-B2 Method for treatment of gastric ulcers and ulcers induced by aspirin COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2010-12-21 US disclosed
EP-1976508-A2 FLAVONOIDS ISOLATED FROM OROXYLUM INDICUM FOR TREATMENT OF GASTROINTESTINAL TOXICITY, ASSOCIATED SYMPTOMS AND ULCERS Council of Scientific and Industrial Research (IN) 2008-10-08 EP disclosed
US-20070213281-A1 Natural agent for treatment of gastrointestinal toxicity, associated symptoms and ulcers COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2007-09-13 US disclosed
WO-2007080484-A2 FLAVONOIDS ISOLATED FROM OROXYLUM INDICUM FOR TREATMENT OF GASTROINTESTINAL TOXICITY, ASSOCIATED SYMPTOMS AND ULCERS COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2007-07-19 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 (4 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-20150174135-A1 FLAVANOID COMPOUNDS AND PROCESS FOR PREPARATION THEREOF F2, FOXM1, HRH2 CREB1 2964/4885FLT3 4064/4885SLCO2B1 3313/4885
US-20110059913-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF GASTROINTESTINAL INDICATIONS MLN, FABP6, SI CREB1 3595/4885FLT3 4368/4885SLCO2B1 1923/4885
US-20120022062-A1 Flavanoid Compounds and Process for Preparation Thereof F2, FOXM1, HRH2 CREB1 2964/4885FLT3 4064/4885SLCO2B1 3313/4885
US-20070213281-A1 Natural agent for treatment of gastrointestinal toxicity, associated symptoms and ulcers FABP6, MLN, SI CREB1 2738/4885FLT3 4324/4885SLCO2B1 2596/4885

“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.