SCHEMBL929235

SCHEMBL929235

Nc1ccccc1C#Cc1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 1.00
MAPT P10636 4/20 1.00
CYP1A2 P05177 4/20 1.00
CYP2C9 P11712 4/20 1.00
CYP2C19 P33261 4/20 1.00
ALDH1A1 P00352 3/20 1.00
NPC1 O15118 2/20 1.00
KDM4E B2RXH2 2/20 1.00
SMN1; SMN2 Q16637 2/20 1.00
MEN1 O00255 2/20 1.00
HPGD P15428 2/20 1.00
KMT2A Q03164 2/20 1.00
HSD17B10 Q99714 2/20 1.00
CASP3 P42574 1/20 0.59
SENP8 Q96LD8 1/20 0.59
SENP7 Q9BQF6 1/20 0.59
SENP6 Q9GZR1 1/20 0.59
APP P05067 2/20 0.57
CA12 O43570 2/20 0.52
CA2 P00918 2/20 0.52

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
SCHEMBL29532077 1.00 CYP3A4 (1.00) CYP3A4MAPTCYP1A2CYP2C9CYP2C19
SCHEMBL29428987 0.98 MAPT (0.95) CYP3A4MAPTCYP1A2CYP2C9CYP2C19
SCHEMBL29616405 0.91 CYP3A4 (0.83) CYP3A4MAPTCYP1A2CYP2C9CYP2C19
SCHEMBL1922269 0.87 CYP3A4 (0.76) CYP3A4MAPTCYP1A2CYP2C9CYP2C19
SCHEMBL22146860 0.86 CYP3A4 (0.76) CYP3A4MAPTCYP1A2CYP2C9CYP2C19
SCHEMBL31277695 0.85 NPC1 (0.73) CYP3A4MAPTCYP1A2CYP2C9CYP2C19
SCHEMBL1886300 0.85 NPC1 (0.73) CYP3A4MAPTCYP1A2CYP2C9CYP2C19
SCHEMBL28686564 0.83 MAPT (0.70) CYP3A4MAPTCYP1A2CYP2C9CYP2C19
SCHEMBL22118337 0.83 ALDH1A1 (0.70) CYP3A4MAPTCYP1A2CYP2C9CYP2C19
SCHEMBL29428994 0.83 MAPT (0.70) CYP3A4MAPTCYP1A2CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114057623-A N-naphthyl indole derivative and synthetic method thereof 湖南第一师范学院 2022-02-18 CN claimed
CN-114031613-A 1- (benzo [ b ] thiophene-7-yl) -indole derivative and synthetic method thereof 湖南第一师范学院 2022-02-11 CN claimed
US-20110003955-A1 Imide Oligomer And Polyimide Resin Obtained By Thermal Curing Thereof DAIWA CAN COMPANY (JP) 2011-01-06 US claimed
EP-2246383-A1 IMIDE OLIGOMER AND POLYIMIDE RESIN OBTAINED BY THERMAL CURING THEREOF DAIWA CAN COMPANY (JP) 2010-11-03 EP claimed
US-7019103-B2 Polyamic acid oligomer, polyimide oligomer, solution composition, and fiber-reinforced composite material JSR CORPORATION (JP) 2006-03-28 US claimed
US-20050014925-A1 Polyamic acid oligomer, polyimide oligomer, solution composition, and fiber-reinforced composite material JSR CORPORATION (JP) 2005-01-20 US claimed
US-5478913-A Copolymerizing biphenyl dianhydride as ester/acid/ with mix of m- or p-phenylenediamines and aminophenoxybenzene component encapped with phthalic anhydride or ethynyl-group amine or anhydride; heat, oxidation resistant; prepregs E. I. DU PONT DE NEMOURS AND COMPANY (US) 1995-12-26 US claimed
EP-0008194-A1 Ethynyl-terminated epoxy resin derivatives and process for making the same Hughes Aircraft Company (US) 1980-02-20 EP claimed
US-4183869-A Ethynyl-terminated epoxy resin derivatives and process for making the same HUGHES AIRCRAFT COMPANY (US) 1980-01-15 US claimed
JP-7238069-A None JP disclosed
WO-2026086794-A1 ANTIMICROBIAL COMPOUNDS AND METHODS OF USE THEREOF THE CHINESE UNIVERSITY OF HONG KONG (CN) 2026-04-30 WO disclosed
US-12492342-B2 Liquid crystal composition and element JNC CORPORATION (JP) 2025-12-09 US disclosed
US-20250277151-A1 LIQUID CRYSTAL COMPOSITION AND ELEMENT JNC CORPORATION (JP) 2025-09-04 US disclosed
US-20250277150-A1 LIQUID CRYSTAL COMPOSITION AND ELEMENT JNC CORPORATION (JP) 2025-09-04 US disclosed
EP-0493650-A1 Fluorinated acetylene-containing aromatic amines and diamines National Starch and Chemical Investment Holding Corporation (US) 1992-07-08 EP disclosed
US-5107026-A Fluorinated acetylene-containing aromatic amines and diamines NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 1992-04-21 US disclosed
US-5107026-A Fluorinated acetylene-containing aromatic amines and diamines NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 1992-04-21 US disclosed
EP-0470446-A1 High glass transition temperature mixed polyimides and composites formed therefrom GENERAL ELECTRIC COMPANY (US) 1992-02-12 EP disclosed
EP-0279921-A2 Phenylacetylene-substituted schiff's base momomers and electroconductive polymers National Starch and Chemical Investment Holding Corporation (US) 1988-08-31 EP disclosed
US-4730032-A MOLDING MATERIALS NATIONAL STARCH AND CHEMICAL CORPORATION (US) 1988-03-08 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 (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-20110003955-A1 Imide Oligomer And Polyimide Resin Obtained By Thermal Curing Thereof PUF60, SMARCC2, SMARCA4 CYP3A4 2757/4885MAPT 1429/4885CYP1A2 3655/4885

“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.