SCHEMBL4552166

SCHEMBL4552166

c1ccc2c(c1)c1ccccc1n2CCCn1c2ccccc2c2ccccc21

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 3/20 0.64
FABP5 Q01469 3/20 0.64
CYP1A2 P05177 2/20 0.64
CYP2C19 P33261 2/20 0.64
MAOA P21397 6/20 0.60
MAOB P27338 6/20 0.60
ACHE P22303 3/20 0.60
SIGMAR1 Q99720 3/20 0.59
DRD3 P35462 1/20 0.59
MEN1 O00255 1/20 0.58
ALDH1A1 P00352 1/20 0.58
TP53 P04637 1/20 0.58
CYP3A4 P08684 1/20 0.58
CYP2D6 P10635 1/20 0.58
CYP2C9 P11712 1/20 0.58
ALOX15 P16050 1/20 0.58
TSHR P16473 1/20 0.58
HTR2A P28223 1/20 0.58
HTR2C P28335 1/20 0.58
MAPK1 P28482 1/20 0.58

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
SCHEMBL4552481 0.95 FABP4 (0.68) FABP4FABP5CYP1A2CYP2C19MAOA
SCHEMBL5181736 0.92 MAOA (0.69) FABP4FABP5CYP1A2CYP2C19MAOA
SCHEMBL6338101 0.92 MAOA (0.69) FABP4FABP5CYP1A2CYP2C19MAOA
SCHEMBL10063551 0.92 MAOA (0.69) FABP4FABP5CYP1A2CYP2C19MAOA
SCHEMBL5658338 0.92 MAOA (0.69) FABP4FABP5CYP1A2CYP2C19MAOA
SCHEMBL9768532 0.89 CYP1A2 (0.70) FABP4FABP5CYP1A2CYP2C19MAOA
SCHEMBL14292496 0.88 FABP4 (0.58) FABP4FABP5CYP1A2CYP2C19MAOA
SCHEMBL4784407 0.87 FABP4 (0.53) FABP4FABP5CYP1A2CYP2C19MAOA
SCHEMBL28813955 0.87 DRD3 (0.78) FABP4FABP5CYP1A2CYP2C19SIGMAR1
SCHEMBL2700703 0.86 FABP4 (0.56) FABP4FABP5CYP1A2CYP2C19MAOA

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8779277-B2 Light energy conversion material KABUSHIKI KAISHA TOYOTA CHUO KENKYUSHO (JP) 2014-07-15 US claimed
US-8247680-B2 Light energy conversion material KABUSHIKI KAISHA TOYOTA CHUO KENKYUSHO (JP) 2012-08-21 US claimed
US-20120181163-A1 LIGHT ENERGY CONVERSION MATERIAL KABUSHIKI KAISHA TOYOTA CHUO KENKYUSHO (JP) 2012-07-19 US claimed
US-11800797-B2 Heterocyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-10-24 US disclosed
US-20230128732-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT MATERIAL AND ORGANIC ELECTROLUMINESCENCE ELEMENT NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2023-04-27 US disclosed
US-20170018719-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2017-01-19 US disclosed
US-20160211466-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2016-07-21 US disclosed
US-8779277-B2 Light energy conversion material KABUSHIKI KAISHA TOYOTA CHUO KENKYUSHO (JP) 2014-07-15 US disclosed
WO-2013148892-A1 BENZYLIDENE DERIVATIVE CHROMOPHORES FOR PHOTOREFRACTIVE COMPOSITIONS NITTO DENKO CORPORATION (JP) 2013-10-03 WO disclosed
US-20130128339-A1 PHOTOREFRACTIVE COMPOSITION RESPONSIVE TO MULTIPLE LASER WAVELENGTHS ACROSS THE VISIBLE LIGHT SPECTRUM NITTO DENKO CORPORATION (JP) 2013-05-23 US disclosed
US-8247680-B2 Light energy conversion material KABUSHIKI KAISHA TOYOTA CHUO KENKYUSHO (JP) 2012-08-21 US disclosed
US-20120181163-A1 LIGHT ENERGY CONVERSION MATERIAL KABUSHIKI KAISHA TOYOTA CHUO KENKYUSHO (JP) 2012-07-19 US disclosed
US-7629060-B2 Liquid crystal cells; durability, stability; brightness ; containing carbazole compound KONICA MINOLTA HOLDINGS, INC. (JP) 2009-12-08 US disclosed
EP-1900429-B1 Light energy conversion material TOYOTA CHUO KENKYUSHO KK (JP) 2009-05-27 EP disclosed
EP-1641894-B1 NOVEL MATERIALS FOR ELECTROLUMINESCENCE MERCK PATENT GMBH (DE) 2009-01-21 EP disclosed
EP-1900429-A1 Light energy conversion material Kabushiki Kaisha Toyota Chuo Kenkyusho (JP) 2008-03-19 EP disclosed
US-20080057420-A1 Silica porous material including an electron donor in skeleton; and an electron acceptor; efficiency, durability KABUSHIKI KAISHA TOYOTA CHUO KENKYUSHO (JP) 2008-03-06 US disclosed
US-20060284140-A1 Novel materials for electroluminescence MERCK PATENT GMBH (DE) 2006-12-21 US disclosed
US-3974167-A (7-Nitro-2-aza-9-fluorenylidene) malononitrile RICOH CO., LTD. (JA) 1976-08-10 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 (2 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-20170018719-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE CD99, BMI1, ETV6 FABP4 3295/4885FABP5 3432/4885CYP1A2 835/4885
US-11800797-B2 Heterocyclic compound and organic light-emitting device including the same CRY1, CYP1A1, CRY2 FABP4 4377/4885FABP5 4548/4885CYP1A2 9/4885

“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.