SCHEMBL451

SCHEMBL451

c1ccc(-n2ccnc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 1.00
MEN1 O00255 2/20 0.77
KMT2A Q03164 2/20 0.77
ALOX15 P16050 1/20 0.77
TSHR P16473 1/20 0.77
CYP2A6 P11509 1/20 0.67
LMNA P02545 2/20 0.63
MAPT P10636 1/20 0.63
ENPP2 Q13822 1/20 0.63
MKNK1 Q9BUB5 1/20 0.63
MKNK2 Q9HBH9 1/20 0.63
NOTUM Q6P988 1/20 0.63
IDO1 P14902 2/20 0.60
CYP11B1 P15538 2/20 0.60
CYP11B2 P19099 2/20 0.60
CYP19A1 P11511 1/20 0.60
USP2 O75604 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
ADH5 P11766 1/20 0.55

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
Ammonia Solution, Strong SCHEMBL3848736 0.98 CYP3A4 (0.95) CYP3A4MEN1KMT2AALOX15TSHR
Hydrochloric Acid SCHEMBL410291 0.98 CYP3A4 (0.95) CYP3A4MEN1KMT2AALOX15TSHR
Hydrochloric Acid SCHEMBL8898731 0.98 CYP3A4 (0.95) CYP3A4MEN1KMT2AALOX15TSHR
Bromide SCHEMBL1954236 0.98 CYP3A4 (0.95) CYP3A4MEN1KMT2AALOX15TSHR
SCHEMBL14157261 0.98 CYP3A4 (0.95) CYP3A4MEN1KMT2AALOX15TSHR
Iodide SCHEMBL28722278 0.98 CYP3A4 (0.95) CYP3A4MEN1KMT2AALOX15TSHR
Phosphine SCHEMBL28849690 0.98 CYP3A4 (0.95) CYP3A4MEN1KMT2AALOX15TSHR
Iodomethane SCHEMBL28292632 0.94 CYP3A4 (0.88) CYP3A4MEN1KMT2AALOX15TSHR
Pyridine SCHEMBL28418720 0.94 CYP3A4 (0.88) CYP3A4MEN1KMT2AALOX15TSHR
SCHEMBL5694115 0.92 CYP3A4 (0.84) CYP3A4MEN1KMT2AALOX15TSHR

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

Appears in 7795 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260146187-A1 EPOXY ADHESIVE COMPOSITION AND EPOXY ADHESIVE STRUCTURE HYUNDAI MOTOR COMPANY (KR) 2026-05-28 US claimed
US-12637541-B2 Alkylene oxide polymerization using aluminum compounds and cyclic amidines DOW GLOBAL TECHNOLOGIES LLC (US) 2026-05-26 US claimed
CN-122051120-A Preparation method of petroleum coke-resin-based hard carbon composite anode material, sodium ion battery and application of sodium ion battery 天宏基科技(深圳)有限公司 2026-05-15 CN claimed
EP-4731688-A1 METHOD FOR THE PRODUCTION OF A HYDROXYL-GROUP TERMINATED OXAZOLIDINONE COMPOSITION Covestro Deutschland AG (DE) 2026-04-29 EP claimed
US-20260071029-A1 POLYIMIDE PRECURSOR COMPOSITION, POLYIMIDE FILM AND POLYIMIDE/SUBSTRATE LAMINATE UBE CORP (JP) 2026-03-12 US claimed
US-20260069538-A1 CXCR4 ANTAGONIST LOADED LIPOSOMES AND SILICASOMES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2026-03-12 US claimed
US-20250382326-A1 MULTIMODAL ANION EXCHANGE LIGANDS FOR PURIFICATION OF VIRAL PARTICLES AND NUCLEIC ACIDS BOARD OF TRUSTEES OF THE UNIVERSITY ARKANSA (US) 2025-12-18 US claimed
US-12428598-B2 Long-afterglow luminescent material FUDAN UNIVERSITY (CN) 2025-09-30 US claimed
US-12429483-B2 System and method for determining onset and disease progression RESPIRATION SCAN LTD (IL) 2025-09-30 US claimed
US-12384869-B2 Process for preparing a polyoxyalkylene carbonate polyol COVESTRO DEUTSCHLAND AG (DE) 2025-08-12 US claimed
CN-86100991-A With Resins, epoxy and carboxy(l)polyester is the preparation method of the powder coating of main component 1986-08-20 CN claimed
US-4584342-A ORGANOPOLYSILOXANE CONTAINING EPOXY GROUPS AND ORGANOPOLYSILOXANE CONTAINING AMINO GROUPS, QUICK-SETTING SHIN-ETSU CHEMICAL CO., LTD. (JP) 1986-04-22 US claimed
US-4404359-A OXIDATION OF SUBSTITUTED MONOHYDRIC PHENOLS, THEN POLYMERIZATION IN PRESENCE OF CATALYST COMPLEX CONSISTING OF COPPER SALT AND N-SUBSTITUTED IMIDAZOLE BASF AKTIENGESELLSCHAFT (DE) 1983-09-13 US claimed
EP-0014237-B1 PHOTOSENSITIVE COATING COMPOSITION AND ITS USE IN THE PRODUCTION OF A NEGATIVE RESIST IMAGE International Business Machines Corporation (US) 1983-04-20 EP claimed
EP-0071081-A1 Process for the preparation of polyphenylene ethers BASF Aktiengesellschaft (DE) 1983-02-09 EP claimed
EP-0014237-A2 Photosensitive coating composition and its use in the production of a negative resist image International Business Machines Corporation (US) 1980-08-20 EP claimed
US-4054728-A Sodium-sulfur batteries BELL TELEPHONE LABORATORIES, INCORPORATED (US) 1977-10-18 US claimed
US-4053444-A COLLOIDAL POLYAMIC ACID ELECTRODEPOSITION COMPOSITIONS AND PROCESS FOR PREPARING SAID COMPOSITIONS WESTINGHOUSE ELECTRIC CORPORATION (US) 1977-10-11 US claimed
US-4003812-A Colloidal polysulfone electrodeposition compositions WESTINGHOUSE ELECTRIC CORPORATION (US) 1977-01-18 US claimed
US-3943065-A Non-colloidal polyamic acid electrodeposition compositions WESTINGHOUSE ELECTRIC CORPORATION (US) 1976-03-09 US claimed