SCHEMBL129750

SCHEMBL129750

CCCOc1cccc(C)c1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.57
DRD4 P21917 2/20 0.57
KMT2A Q03164 2/20 0.56
DRD3 P35462 1/20 0.56
TDP1 Q9NUW8 3/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
KDM4E B2RXH2 1/20 0.54
ACHE P22303 1/20 0.54
F2 P00734 1/20 0.53
RAB9A P51151 1/20 0.53
HSD17B10 Q99714 2/20 0.51
MAPK1 P28482 1/20 0.51
POLB P06746 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
LMNA P02545 1/20 0.50
HTT P42858 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50

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
SCHEMBL30167657 1.00 DRD2 (0.57) DRD2DRD4KMT2ADRD3TDP1
Ammonia Solution, Strong SCHEMBL9124747 0.98 DRD2 (0.56) DRD2DRD4KMT2ADRD3TDP1
SCHEMBL3894255 0.90 DRD2 (0.63) DRD2DRD4KMT2ADRD3TDP1
SCHEMBL29381067 0.89 DRD2 (0.62) DRD2DRD4KMT2ADRD3TDP1
SCHEMBL27465 0.89 DRD2 (0.62) DRD2DRD4KMT2ADRD3TDP1
SCHEMBL23267298 0.89 MAPK1 (0.61) DRD2DRD4KMT2ADRD3TDP1
SCHEMBL12206636 0.89 MAPK1 (0.61) DRD2DRD4KMT2ADRD3TDP1
SCHEMBL17214432 0.89 MAPK1 (0.61) DRD2DRD4KMT2ADRD3TDP1
SCHEMBL12301114 0.88 TSHR (0.64) DRD2DRD4DRD3TDP1L3MBTL1
SCHEMBL11674802 0.87 DRD2 (0.66) DRD2DRD4KMT2ADRD3TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11858907-B2 Kinase modulators RHIZEN PHARMACEUTICALS AG (CH) 2024-01-02 US disclosed
US-11858907-B2 Kinase modulators RHIZEN PHARMACEUTICALS AG (CH) 2024-01-02 US disclosed
WO-2023224029-A1 SARS-COV-2 INHIBITOR 国立大学法人東海国立大学機構 2023-11-23 WO disclosed
US-20230346753-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR THE INHIBITION OF NAMPT VALO HEALTH, INC. 2023-11-02 US disclosed
US-20230346753-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR THE INHIBITION OF NAMPT VALO HEALTH, INC. 2023-11-02 US disclosed
US-20230265054-A1 PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING GENENTECH, INC. (US) 2023-08-24 US disclosed
US-20230183286-A1 NOVEL 3' END CAPS, 5' END CAPS AND COMBINATIONS THEREOF FOR THERAPEUTIC RNA NOVARTIS AG (CH) 2023-06-15 US disclosed
US-20230183286-A1 NOVEL 3' END CAPS, 5' END CAPS AND COMBINATIONS THEREOF FOR THERAPEUTIC RNA NOVARTIS AG (CH) 2023-06-15 US disclosed
US-20230152695-A1 RESIST UNDERLAYER FILM MATERIAL, PATTERNING PROCESS, AND METHOD FOR FORMING RESIST UNDERLAYER FILM SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-05-18 US disclosed
US-20230151159-A1 COMPOUND FOR FORMING HARDMASK, HARDMASK COMPOSITION INCLUDING THE COMPOUND, AND METHOD OF MANUFACTURING INTEGRATED CIRCUIT DEVICE USING THE HARDMASK COMPOSITION SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-05-18 US disclosed
US-5679856-A OXYBROMINATION OF A PHENOL ETHER COMPOUND USING ELEMENTAL BROMINE IN THE PRESENCE OF HYDROGEN PEROXIDE AND A CATALYST; REACTING WITH FORMANILIDE CIBA-GEIGY CORPORATION (US) 1997-10-21 US disclosed
US-5563159-A Dithiocarbonimide derivatives useful as acaricidal, fungicidal, and insecticidal agents SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-10-08 US disclosed
EP-0727411-A2 Process for the preparation of diphenylamines CIBA-GEIGY AG (CH) 1996-08-21 EP disclosed
CN-1007153-B PREPN. OF BENZOTHIOPHENES AND BENZOFURANS HAVING ANTIALLERGY ACTIVITY WARNER LAMBERT CO (US) 1990-03-14 CN disclosed
CN-85109587-A Have the new benzothiophene kind of antiallergic activity and the preparation method of benzofuran compounds 1986-12-17 CN disclosed
US-4393241-A Synthesis of alkoxy and phenoxy substituted aryl sulfides CELANESE CORPORATION (US) 1983-07-12 US disclosed
US-4354904-A Electrochemical oxidation of alkyl aromatic compounds UOP INC. (US) 1982-10-19 US disclosed
US-4212711-A Electrochemical oxidation of alkyl aromatic compounds UOP INC. (US) 1980-07-15 US disclosed
US-4212710-A Electrochemical oxidation of alkyl aromatic compounds UOP INC. (US) 1980-07-15 US disclosed
US-4148696-A Electrochemical oxidation of activated alkyl aromatic compounds UOP INC. (US) 1979-04-10 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 (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-20230183286-A1 NOVEL 3' END CAPS, 5' END CAPS AND COMBINATIONS THEREOF FOR THERAPEUTIC RNA RNGTT, NSUN2, NSUN3 DRD2 4125/4885DRD4 3221/4885KMT2A 1755/4885
US-20230265054-A1 PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING SHH, GLI1, SMO DRD2 3308/4885DRD4 3430/4885KMT2A 1528/4885
US-11858907-B2 Kinase modulators RPS6KA1, RPS6KA2, PRKAR2A DRD2 4750/4885DRD4 4840/4885KMT2A 3863/4885
US-20230346753-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR THE INHIBITION OF NAMPT NAMPT, NNMT, NQO1 DRD2 2745/4885DRD4 2506/4885KMT2A 1615/4885

“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.