SCHEMBL875358

SCHEMBL875358

CCCc1ccc(N=Nc2ccccc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.52
MAPK1 P28482 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
TSHR P16473 1/20 0.47
HSD17B10 Q99714 1/20 0.47
MAPT P10636 4/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
RAB9A P51151 3/20 0.46
NPC1 O15118 2/20 0.46
PKM P14618 1/20 0.46
HTT P42858 1/20 0.46
PPARA Q07869 5/20 0.43
PPARG P37231 3/20 0.43
PPARD Q03181 2/20 0.43
TRPA1 O75762 1/20 0.42
LPL P06858 1/20 0.42
LIPG Q9Y5X9 1/20 0.42
SIGMAR1 Q99720 1/20 0.41
CHRNA7 P36544 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
SCHEMBL12786219 1.00 ALDH1A1 (0.52) ALDH1A1MAPK1TDP1TSHRHSD17B10
SCHEMBL20852371 0.91 LPL (0.48) LPLLIPGCHRNA7L3MBTL1CYP2D6
SCHEMBL11881823 0.88 CYP3A4 (0.50) ALDH1A1MAPK1TDP1TSHRHSD17B10
SCHEMBL19281434 0.88 CYP3A4 (0.50) ALDH1A1MAPK1TDP1TSHRHSD17B10
SCHEMBL13278248 0.86 ALDH1A1 (0.63) ALDH1A1MAPK1TDP1TSHRHSD17B10
SCHEMBL13278246 0.86 ALDH1A1 (0.63) ALDH1A1MAPK1TDP1TSHRHSD17B10
SCHEMBL16100133 0.86 HTR2A (0.51) ALDH1A1HSD17B10PPARAPPARGLPL
SCHEMBL31644237 0.86 HTR2A (0.51) ALDH1A1HSD17B10PPARAPPARGLPL
SCHEMBL1788376 0.84 HTR2A (0.54) ALDH1A1HSD17B10MAPTMEN1KMT2A
SCHEMBL6278102 0.84 HTR2A (0.54) ALDH1A1HSD17B10MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116327427-A In situ adjustable artificial lens 爱尔康公司 2023-06-27 CN disclosed
CN-113677378-B In situ adjustable artificial lens 爱尔康公司 2023-05-16 CN disclosed
CN-113677378-A In situ tunable intraocular lenses 爱尔康公司 2021-11-19 CN disclosed
EP-2983659-B1 DRUG DELIVERY POLYMER AND USES THEREOF MASSACHUSETTS INST TECHNOLOGY (US) 2019-11-20 EP disclosed
EP-3497446-A1 METHOD AND COMPOSITION FOR DETECTION OF PEPTIDE CYCLIZATION USING PROTEIN TAGS H. Hoffnabb-La Roche Ag (CH) 2019-06-19 EP disclosed
WO-2018033478-A1 METHOD AND COMPOSITION FOR DETECTION OF PEPTIDE CYCLIZATION USING PROTEIN TAGS F. HOFFMANN-LA ROCHE AG (CH) 2018-02-22 WO disclosed
EP-3140310-A1 SYNTHESIS OF BORONATE SALTS AND USES THEREOF Rempex Pharmaceuticals, Inc. (US) 2017-03-15 EP disclosed
WO-2015171430-A1 SYNTHESIS OF BORONATE SALTS AND USES THEREOF REMPEX PHARMACEUTICALS, INC. (US) 2015-11-12 WO disclosed
EP-2861565-A2 SUBSTITUTED MACROCYCLIC COMPOUNDS HAVING PROTEASOME INHIBITORY ACTIVITY The Regents of The University of California (US) 2015-04-22 EP disclosed
WO-2013188750-A2 SUBSTITUTED MACROCYCLIC COMPOUNDS HAVING PROTEASOME INHIBITORY ACTIVITY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2013-12-19 WO disclosed
WO-2003091264-A2 NON NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS GILEAD SCIENCES, INC. (US) 2003-11-06 WO disclosed
EP-1283837-A1 NEW THIOCHROMANE DERIVATIVES AND THEIR USE AS THROMBIN INHIBITORS AstraZeneca AB (SE) 2003-02-19 EP disclosed
WO-2001087879-A1 NEW THIOCHROMANE DERIVATIVES AND THEIR USE AS THROMBIN INHIBITORS ASTRAZENECA AB (SE) 2001-11-22 WO disclosed
WO-2000029385-A1 1,4,5,6-TETRAHYDRO-PYRIDAZINE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS NEURAMINIDASE INHIBITORS GILEAD SCIENCES, INC. (US) 2000-05-25 WO disclosed
EP-0938475-A1 PIPERIDINE COMPOUNDS GILEAD SCIENCES, INC. (US) 1999-09-01 EP disclosed
EP-0920410-A1 PREPARATION OF CYCLOHEXENE CARBOXYLATE DERIVATIVES GILEAD SCIENCES, INC. (US) 1999-06-09 EP disclosed
WO-1999010365-A2 5',5'-LINKED OLIGOMERS HAVING ANTI-THROMBIN ACTIVITY GILEAD SCIENCES, INC. (US) 1999-03-04 WO disclosed
WO-1998017647-A1 PIPERIDINE COMPOUNDS GILEAD SCIENCES, INC. (US) 1998-04-30 WO disclosed
WO-1998007685-A1 PREPARATION OF CYCLOHEXENE CARBOXYLATE DERIVATIVES GILEAD SCIENCES, INC. (US) 1998-02-26 WO disclosed
WO-1997049723-A1 CATIONIC LIPIDS FOR DELIVERY OF NUCLEIC ACID TO CELLS GILEAD SCIENCES, INC. (US) 1997-12-31 WO disclosed