SCHEMBL3620867

SCHEMBL3620867

CCCCc1ccc(N=Cc2ccc(C=Nc3ccc(CCCC)cc3)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.60
CYP2D6 P10635 2/20 0.60
CYP2C9 P11712 2/20 0.60
GRIN2D O15399 1/20 0.55
GRIN3B O60391 1/20 0.55
GRIN1 Q05586 1/20 0.55
GRIN2A Q12879 1/20 0.55
GRIN2B Q13224 1/20 0.55
GRIN2C Q14957 1/20 0.55
GRIN3A Q8TCU5 1/20 0.55
ALDH1A1 P00352 4/20 0.47
HSD17B10 Q99714 3/20 0.47
THRB P10828 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
KDM4E B2RXH2 2/20 0.47
TP53 P04637 2/20 0.47
MEN1 O00255 1/20 0.47
MAPT P10636 1/20 0.47
ALOX15 P16050 1/20 0.47
MAPK1 P28482 1/20 0.47

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
SCHEMBL6635785 1.00 CYP3A4 (0.60) CYP3A4CYP2D6CYP2C9GRIN2DGRIN3B
SCHEMBL11524101 1.00 CYP3A4 (0.60) CYP3A4CYP2D6CYP2C9GRIN2DGRIN3B
SCHEMBL10346503 0.96 CYP3A4 (0.58) CYP3A4CYP2D6CYP2C9GRIN2DGRIN3B
SCHEMBL12416611 0.96 CYP3A4 (0.58) CYP3A4CYP2D6CYP2C9GRIN2DGRIN3B
SCHEMBL1129722 0.95 CYP2C9 (0.55) CYP3A4CYP2D6CYP2C9GRIN2DGRIN3B
SCHEMBL1129724 0.95 CYP2C9 (0.55) CYP3A4CYP2D6CYP2C9GRIN2DGRIN3B
SCHEMBL5665735 0.93 CYP3A4 (0.54) CYP3A4CYP2D6CYP2C9GRIN2DGRIN3B
SCHEMBL5665730 0.93 CYP3A4 (0.54) CYP3A4CYP2D6CYP2C9GRIN2DGRIN3B
SCHEMBL12416633 0.93 CYP3A4 (0.62) CYP3A4CYP2D6CYP2C9GRIN2DGRIN3B
SCHEMBL3623036 0.93 CYP3A4 (0.62) CYP3A4CYP2D6CYP2C9GRIN2DGRIN3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6835456-B2 Base polymer of a polyamide having pendant hydroxyl groups or polybenzoxazole and as dye component methine dyes, azomethine dyes, coumarin dyes, triarylmethane dyes and/or azo dyes and their derivatives; ARC coatings (antireflective coatings) INFINEON TECHNOLOGIES AG (DE) 2004-12-28 US claimed
US-20020198294-A1 Antireflective, layer-forming composition, layer configuration containing the antireflective layer, and process for producing the antireflective layer POLARIS INNOVATIONS LIMITED (IE) 2002-12-26 US claimed
US-10996496-B2 Composite film, device including, and method of forming the same NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2021-05-04 US disclosed
EP-3500890-A1 COMPOSITE FILM, DEVICE INCLUDING, AND METHOD OF FORMING THE SAME Nanyang Technological University (SG) 2019-06-26 EP disclosed
US-20190179176-A1 COMPOSITE FILM, DEVICE INCLUDING, AND METHOD OF FORMING THE SAME NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2019-06-13 US disclosed
EP-2799516-B1 LIQUID CRYSTAL MATERIAL OF SMECTIC PHASE IN HIGH SCATTERING STATE AND DISPLAY DEVICE THEREOF HALATION PHOTONICS CORP (CN) 2019-02-20 EP disclosed
US-9175220-B2 High scattering smectic liquid crystal material and display device using the same HALATION PHOTONICS CORPORATION (CN) 2015-11-03 US disclosed
US-9175220-B2 High scattering smectic liquid crystal material and display device using the same HALATION PHOTONICS CORPORATION (CN) 2015-11-03 US disclosed
US-20100302487-A1 PHASE COMPENSATION FILM DOW GLOBAL TECHNOLOGIES LLC 2010-12-02 US disclosed
US-20100294989-A1 SMALL SCALE FUNCTIONAL MATERIALS DOW GLOBAL TECHNOLOGIES LLC 2010-11-25 US disclosed
EP-2231760-A1 SMALL SCALE FUNCTIONAL MATERIALS Dow Global Technologies Inc. (US) 2010-09-29 EP disclosed
US-20020045628-A1 Arylpiperazinyl-cyclohexyl indole derivatives for the treatment of depression AMERICAN HOME PRODUCTS CORPORATION (US) 2002-04-18 US disclosed
US-6313126-B1 FOR THRERAPY OF DISORDERS ASSOCIATED WITH DYSFUNCTION IN SEROTONERGIC NEUROTRANSMISSION, INCLUDING DEPRESSION AND ANXIETY AMERICAN HOME PRODUCTS CORP 2001-11-06 US disclosed
EP-1147083-A1 ARYLPIPERAZINYL-CYCLOHEXYL INDOLE DERIVATIVES FOR THE TREATMENT OF DEPRESSION AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-24 EP disclosed
WO-2000040554-A1 ARYLPIPERAZINYL-CYCLOHEXYL INDOLE DERIVATIVES FOR THE TREATMENT OF DEPRESSION AMERICAN HOME PRODUCTS CORPORATION (US) 2000-07-13 WO disclosed
US-5068052-A Polyoxymethylene resin and liquid crystal polyester for films or fibers POLYPLASTICS CO., LTD. (JP) 1991-11-26 US disclosed
EP-0106175-B1 ELECTRICALLY CONDUCTIVE LIQUID CRYSTALLINE SUBSTANCE AND POLYMER SHOWA DENKO KABUSHIKI KAISHA (JP) 1988-12-07 EP disclosed
US-4769448-A CHARGE TRANSFER COMPOUNDS SHOWA DENKO KABUSHIKI KAISHA (JP) 1988-09-06 US disclosed
US-4657694-A CONTAINING A CHARGE TRANSFER COMPOUND SHOWA DENKO KABUSHIKI KAISHA (JP) 1987-04-14 US disclosed
EP-0106175-A2 Electrically conductive liquid crystalline substance and polymer SHOWA DENKO KABUSHIKI KAISHA (JP) 1984-04-25 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 (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-20020045628-A1 Arylpiperazinyl-cyclohexyl indole derivatives for the treatment of depression HTR2C, TPH1, TPH2 CYP3A4 410/4885CYP2D6 278/4885CYP2C9 737/4885

“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.