SCHEMBL1387828

SCHEMBL1387828

C1=C(c2ccccc2)C(c2ccccc2)c2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CFTR P13569 1/20 0.38
GOPC Q9HD26 1/20 0.38
LMNA P02545 3/20 0.33
CYP1A2 P05177 3/20 0.33
TP53 P04637 2/20 0.33
CYP3A4 P08684 2/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
HTR2B P41595 1/20 0.33
HTR2A P28223 1/20 0.31
ALDH1A1 P00352 2/20 0.31
HSD17B10 Q99714 2/20 0.31
ADRA2C P18825 1/20 0.31
PTGS2 P35354 1/20 0.31
HRH1 P35367 1/20 0.31
HTR3A P46098 1/20 0.31
PDE4D Q08499 1/20 0.31
CYP19A1 P11511 1/20 0.31
CYP11B1 P15538 1/20 0.31
CYP11B2 P19099 1/20 0.31

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
Acetone SCHEMBL28756352 0.90 EDNRA (0.36) CFTRGOPCLMNACYP3A4MAPT
SCHEMBL5967745 0.83 MEN1 (0.34) CFTRGOPCLMNAMAPTMAPK1
SCHEMBL6924825 0.81 EGFR (0.37) CYP1A2TP53CYP3A4HTR2BALDH1A1
SCHEMBL29008132 0.78 HTR2A (0.34) CFTRGOPCCYP3A4HTR2AALDH1A1
SCHEMBL7576497 0.76 HDAC4 (0.33) CFTRGOPCALDH1A1CYP19A1CYP11B1
SCHEMBL13414982 0.76 CYP2A6 (0.39) CYP1A2TP53MAPTMAPK1ALDH1A1
SCHEMBL3213322 0.75 ADORA2A (0.36) LMNACYP1A2ALDH1A1GAAHPGD
SCHEMBL27448383 0.75 ALDH1A1 (0.33) CFTRGOPCALDH1A1CYP19A1CYP11B1
SCHEMBL6673270 0.73 GAA (0.35) LMNACYP1A2TP53CYP3A4MAPT
SCHEMBL15661815 0.73 HDAC4 (0.38) LMNACYP1A2TP53CYP3A4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2859069-B1 METHOD AND APPARATUS FOR TREATING PETROLEUM EQUIPMENT FERRARA MARCELLO (IT) 2020-10-14 EP claimed
US-9328300-B2 Method, apparatus and chemical products for treating petroleum equipment FERRARA MARCELLO (IT) 2016-05-03 US claimed
EP-2859069-A1 METHOD AND APPARATUS FOR TREATING PETROLEUM EQUIPMENT Ferrara, Marcello (IT) 2015-04-15 EP claimed
WO-2013156228-A1 METHOD AND APPARATUS FOR TREATING PETROLEUM EQUIPMENT FERRARA MARCELLO (IT) 2013-10-24 WO claimed
US-20130270157-A1 METHOD, APPARATUS AND CHEMICAL PRODUCTS FOR TREATING PETROLEUM EQUIPMENT FERRARA MARCELLO (IT) 2013-10-17 US claimed
US-20020002177-A1 Endothelin receptor antagonists SMITHKLINE BEECHAM CORPORATION 2002-01-03 US claimed
JP-H08510211-A 1996-10-29 JP claimed
EP-0699069-A4 1996-04-03 EP claimed
EP-0699069-A1 ENDOTHELIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1996-03-06 EP claimed
WO-1995020637-A2 HYDROCARBON OIL-AQUEOUS FUEL AND ADDITIVE COMPOSITIONS MEG S.N.C. DI SCOPELLITI SOFIA & C. (IT) 1995-08-03 WO claimed
WO-1994025013-A1 ENDOTHELIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1994-11-10 WO claimed
JP-7300434-A None JP disclosed
CN-113330078-B Release layer and product containing release layer 3M创新有限公司 2022-12-02 CN disclosed
CN-113330078-A Release layer and product containing release layer 3M创新有限公司 2021-08-31 CN disclosed
CN-113122048-A Ink composition and method of printing ink 施乐公司 2021-07-16 CN disclosed
EP-0699069-A1 ENDOTHELIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1996-03-06 EP disclosed
JP-H07300434-A 2,3-DIPHENYLINDENE COMPOUND AND PHOTORECEPTOR FOR ELECTROPHOTOGRAPHY CONTAINING THE SAME COMPOUND RICOH CO LTD 1995-11-14 JP disclosed
WO-1995020637-A2 HYDROCARBON OIL-AQUEOUS FUEL AND ADDITIVE COMPOSITIONS MEG S.N.C. DI SCOPELLITI SOFIA & C. (IT) 1995-08-03 WO disclosed
WO-1994025013-A1 ENDOTHELIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1994-11-10 WO disclosed
US-4182915-A PHENOL FROM BENZENE BY REACTION OF THALLIUM/III/ METALLATE WITH HYDROXYL DONOR HALCON INTERNATIONAL, INC. (US) 1980-01-08 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 (1 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-20020002177-A1 Endothelin receptor antagonists EDNRA, EDNRB, ECE1 CFTR 1621/4885GOPC 3560/4885LMNA 2153/4885

“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.