SCHEMBL905671

SCHEMBL905671

CCCCCCCCCCOc1ccccc1N

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.85
CYP2C9 P11712 1/20 0.85
CYP2C19 P33261 1/20 0.85
ALDH1A1 P00352 5/20 0.62
MEN1 O00255 2/20 0.58
MAPT P10636 2/20 0.58
KMT2A Q03164 2/20 0.58
NR1I2 O75469 1/20 0.58
LMNA P02545 1/20 0.58
CHRM2 P08172 1/20 0.58
CYP3A4 P08684 1/20 0.58
ADRA2A P08913 1/20 0.58
OPRK1 P41145 1/20 0.58
HTR2B P41595 1/20 0.58
SLC6A3 Q01959 1/20 0.58
HDAC6 Q9UBN7 1/20 0.58
MCHR1 Q99705 3/20 0.54
TLR8 Q9NR97 3/20 0.54
KDM4E B2RXH2 2/20 0.53
POLB P06746 2/20 0.53

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
SCHEMBL21694180 1.00 CYP1A2 (0.85) CYP1A2CYP2C9CYP2C19ALDH1A1MEN1
SCHEMBL10408892 1.00 CYP1A2 (0.85) CYP1A2CYP2C9CYP2C19ALDH1A1MEN1
SCHEMBL18049454 1.00 CYP1A2 (0.85) CYP1A2CYP2C9CYP2C19ALDH1A1MEN1
SCHEMBL3523843 1.00 CYP1A2 (0.85) CYP1A2CYP2C9CYP2C19ALDH1A1MEN1
SCHEMBL8389395 1.00 CYP1A2 (0.85) CYP1A2CYP2C9CYP2C19ALDH1A1MEN1
SCHEMBL4950279 1.00 CYP1A2 (0.85) CYP1A2CYP2C9CYP2C19ALDH1A1MEN1
SCHEMBL10430130 1.00 CYP1A2 (0.85) CYP1A2CYP2C9CYP2C19ALDH1A1MEN1
SCHEMBL5085710 1.00 CYP1A2 (0.85) CYP1A2CYP2C9CYP2C19ALDH1A1MEN1
Hydrochloric Acid SCHEMBL4942615 0.98 CYP1A2 (0.82) CYP1A2CYP2C9CYP2C19ALDH1A1MEN1
SCHEMBL1341248 0.98 CYP1A2 (0.89) CYP1A2CYP2C9CYP2C19ALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110499164-B Liquid crystal alignment agent, liquid crystal alignment film and liquid crystal display element 奇美实业股份有限公司 2023-12-05 CN disclosed
CN-107880902-B Liquid crystal alignment agent, liquid crystal alignment film and liquid crystal display assembly 奇美实业股份有限公司 2023-07-25 CN disclosed
CN-108003896-B Liquid crystal alignment agent, liquid crystal alignment film and liquid crystal display element 奇美实业股份有限公司 2022-10-21 CN disclosed
CN-109085722-B Method for manufacturing liquid crystal alignment film and liquid crystal display element 奇美实业股份有限公司 2022-05-10 CN disclosed
CN-109207170-B Liquid crystal alignment agent, liquid crystal alignment film and liquid crystal display element 奇美实业股份有限公司 2021-12-10 CN disclosed
WO-2020032090-A1 EPOXY COMPOUND, EPOXY RESIN, EPOXY RESIN COMPOSITION, CURED RESIN PRODUCT, PREPREG, FIBER-REINFORCED COMPOSITE MATERIAL, AND PRODUCTION METHOD FOR THESE 帝人株式会社 2020-02-13 WO disclosed
EP-2277595-A2 Compounds for immunopotentiation Novartis Vaccines and Diagnostics, Inc. (US) 2011-01-26 EP disclosed
US-20100226931-A1 Compounds for immunopotentiation NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2010-09-09 US disclosed
EP-1765313-A2 COMPOUNDS FOR IMMUNOPOTENTIATION Novartis Vaccines and Diagnostics, Inc. (US) 2007-03-28 EP disclosed
WO-2006002422-A9 COMPOUNDS FOR IMMUNOPOTENTIATION CHIRON CORP (US) 2006-09-21 WO disclosed
EP-0970070-B1 PHTHALAZINES WITH ANGIOGENESIS INHIBITING ACTIVITY NOVARTIS AG (CH) 2004-10-06 EP disclosed
US-6710047-B2 INHIBIT THE ACTIVITY OF THE VEGF RECEPTOR TYROSINE KINASE AND THE GROWTH OF TUMOURS NOVARTIS AG (CH) 2004-03-23 US disclosed
US-20030191129-A1 Phthalazines with angiogenesis inhibiting activity BOLD GUIDO (CH) 2003-10-09 US disclosed
US-6514974-B2 1-(4-Chloroanilino)-4-(4-pyridylmethyl)phthalazine for example NOVARTIS AG (CH) 2003-02-04 US disclosed
US-20020091261-A1 Phthalazines with angiogenesis inhibiting activity BOLD GUIDO (CH) 2002-07-11 US disclosed
US-6258812-B1 ANGIOGENESIS INHIBITORS, ANTITUMOR AGENTS AND CARDIOVASCULAR DISORDERS NOVARTIS AG (CH) 2001-07-10 US disclosed
EP-0970070-A1 PHTHALAZINES WITH ANGIOGENESIS INHIBITING ACTIVITY Novartis AG (CH) 2000-01-12 EP disclosed
WO-1998035958-A1 PHTHALAZINES WITH ANGIOGENESIS INHIBITING ACTIVITY NOVARTIS AG (CH) 1998-08-20 WO disclosed
EP-0116931-B1 DIARYLOXAL AMIDES AND THEIR USE AS UV ABSORBERS, AND POLYMERIC SUBSTRATES CONTAINING THEM BASF Aktiengesellschaft (DE) 1986-08-06 EP disclosed
EP-0116931-A1 Diaryloxal amides and their use as UV absorbers, and polymeric substrates containing them BASF Aktiengesellschaft (DE) 1984-08-29 EP 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 (3 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-20030191129-A1 Phthalazines with angiogenesis inhibiting activity PGF, VEGFA, FLT4 CYP1A2 1081/4885CYP2C9 2308/4885CYP2C19 2575/4885
US-20100226931-A1 Compounds for immunopotentiation LY96, ICOS, PDCD1 CYP1A2 3446/4885CYP2C9 3960/4885CYP2C19 2969/4885
US-20020091261-A1 Phthalazines with angiogenesis inhibiting activity PGF, VEGFA, FLT4 CYP1A2 1333/4885CYP2C9 2640/4885CYP2C19 2769/4885

“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.