SCHEMBL3340538

SCHEMBL3340538

O=C1Cc2c(O)cccc2N1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.48
PDK2 Q15119 1/20 0.48
DRD2 P14416 5/20 0.45
DRD4 P21917 4/20 0.45
DRD3 P35462 4/20 0.45
DRD1 P21728 2/20 0.45
DRD5 P21918 2/20 0.45
KDM4E B2RXH2 1/20 0.45
LMNA P02545 1/20 0.45
CHRM2 P08172 1/20 0.45
CYP3A4 P08684 1/20 0.45
HTR1A P08908 1/20 0.45
ADRA2A P08913 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
ADRA2B P18089 1/20 0.45
HTR2A P28223 1/20 0.45
MAPK1 P28482 1/20 0.45
CYP2C19 P33261 1/20 0.45
ADRA1A P35348 1/20 0.45

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
SCHEMBL30463280 1.00 AHR (0.48) AHRPDK2DRD2DRD4DRD3
SCHEMBL29863302 0.82 NPC1 (0.50) AHRPDK2HTR1AOPRK1CRBN
SCHEMBL98299 0.82 NPC1 (0.50) AHRPDK2HTR1AOPRK1CRBN
SCHEMBL18403203 0.80 PNMT (0.43) AHRPDK2DRD2DRD4DRD3
SCHEMBL6407953 0.79 MAPT (0.53) AHRPDK2CRBNPARP1
SCHEMBL20597383 0.78 MAOA (0.40) AHRPDK2DRD2DRD4DRD3
SCHEMBL20597191 0.78 CREBBP (0.38) AHRPDK2CRBNPARP1WDR91
SCHEMBL20597531 0.77 PLCG1 (0.45) AHRPDK2DRD2DRD4DRD3
SCHEMBL8402074 0.76 BCL2L1 (0.35) DRD2DRD3DRD1DRD5LMNA
SCHEMBL624585 0.76 CCNB2 (0.54) AHRPDK2DRD2DRD4DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112079764-B Synthesis method of sunitinib intermediate 5-fluoroindol-2-one 山东汇海医药化工有限公司 2023-08-01 CN disclosed
CN-112079764-A Synthesis method of sunitinib intermediate 5-fluoroindole-2-ketone 山东汇海医药化工有限公司 2020-12-15 CN disclosed
CN-111479485-A Hair dyeing kit and composition for use in hair dyeing kit 莱雅公司 2020-07-31 CN disclosed
CN-111334079-A Full-spectrum high-brightness and high-stability fluorescent dye and synthesis and application thereof 中国科学院大连化学物理研究所 2020-06-26 CN disclosed
US-9028562-B2 Dye composition using a 2-hydroxynaphthalene, (acylamino)phenol or quinoline coupler in a fatty-substance-rich medium, dyeing process and device therefor L'OREAL (FR) 2015-05-12 US disclosed
US-9028562-B2 Dye composition using a 2-hydroxynaphthalene, (acylamino)phenol or quinoline coupler in a fatty-substance-rich medium, dyeing process and device therefor L'OREAL (FR) 2015-05-12 US disclosed
US-20140041133-A1 DYE COMPOSITION USING A 2-HYDROXYNAPHTHALENE, (ACYLAMINO)PHENOL OR QUINOLINE COUPLER IN A FATTY-SUBSTANCE-RICH MEDIUM, DYEING PROCESS AND DEVICE THEREFOR L'OREAL (FR) 2014-02-13 US disclosed
US-20140041133-A1 DYE COMPOSITION USING A 2-HYDROXYNAPHTHALENE, (ACYLAMINO)PHENOL OR QUINOLINE COUPLER IN A FATTY-SUBSTANCE-RICH MEDIUM, DYEING PROCESS AND DEVICE THEREFOR L'OREAL (FR) 2014-02-13 US disclosed
US-20100158842-A1 NATURAL SKIN WHITENER: 4-HYDROXY-OXINDOLE-3-ACETIC ACID SPECTRUM DYNAMICS LLC 2010-06-24 US disclosed
US-20100004238-A1 FUSED HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-01-07 US disclosed
US-6506901-B2 1-(9H-Carbazol-4-yloxy)-3-((1-(7-trifluoromethyl-quinolin-4-yl) -piperidin-4-lmethyl)-amino)-propan-2-ol, for example; treating diabetes, urinary continence, atherosclerosis, gastrointestinal disorders, glaucoma WYETH 2003-01-14 US disclosed
WO-2002038543-A2 3-SUBSTITUTED OXINDOLE BETA 3 AGONISTS ELI LILLY AND COMPANY (US) 2002-05-16 WO disclosed
WO-2002038544-A2 3-SUBSTITUTED OXINDOLE BETA 3 AGONISTS ELI LILLY AND COMPANY (US) 2002-05-16 WO disclosed
US-20020037907-A1 Substituted 2- (S) -hydroxy-3- (piperidin-4-yl-methylamino) -propyl ethers and substituted 2-aryl-2- (R) - hydroxy-1- (piperidin-4-yl-methyl) -ethylamine beta-3 adrenergic receptor agonists AMERICAN HOME PRODUCTS CORPORATION (US) 2002-03-28 US disclosed
WO-2002006255-A2 HYDROXY-(PIPERIDIN-4-YL-METHYLAMINO)-ALKYL BETA-3 ADRENERGIC RECEPTOR ANTAGONISTS WYETH (US) 2002-01-24 WO disclosed
JP-2001226351-A METHOD FOR PRODUCING 4-HYDROXYOXYINDOLE DAISO CO LTD 2001-08-21 JP disclosed
WO-1994003425-A2 CARBOSTYRIL DERIVATIVES FOR THE TREATMENT OF ARRHYTHMIA SYNTEX (U.S.A.) INC. (US) 1994-02-17 WO disclosed
US-4622336-A ANALGESICS SANDOZ LTD. (CH) 1986-11-11 US disclosed
WO-1983002610-A1 DERIVATIVES OF 3,3-DIALKYL-INDOLIN AND OF 3,3-ALKYLENE-INDOLIN, METHOD FOR PRODUCING THEM AND PHARMACEUTICAL PREPARATIONS CONTAINING THEM SANDOZ AG (CH) 1983-08-04 WO disclosed
US-3965095-A Oxindole derivatives SANDOZ LTD. (CH) 1976-06-22 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 (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-20140041133-A1 DYE COMPOSITION USING A 2-HYDROXYNAPHTHALENE, (ACYLAMINO)PHENOL OR QUINOLINE COUPLER IN A FATTY-SUBSTANCE-RICH MEDIUM, DYEING PROCESS AND DEVICE THEREFOR HADHB, HADH, FABP4 AHR 5/4885PDK2 738/4885DRD2 1745/4885
US-20020037907-A1 Substituted 2- (S) -hydroxy-3- (piperidin-4-yl-methylamino) -propyl ethers and substituted 2-aryl-2- (R) - hydroxy-1- (piperidin-4-yl-methyl) -ethylamine beta-3 adrenergic receptor agonists GPR119, ADRB1, ADRB2 AHR 225/4885PDK2 2998/4885DRD2 325/4885
US-20100004238-A1 FUSED HETEROCYCLIC COMPOUND ERBB2, ROS1, FLT3 AHR 259/4885PDK2 576/4885DRD2 1841/4885

“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.