SCHEMBL110689

SCHEMBL110689

NCc1cccc2ccccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.58
CYP2C19 P33261 2/20 0.58
CYP2C9 P11712 1/20 0.58
CYP2D6 P10635 2/20 0.54
TDP1 Q9NUW8 1/20 0.52
HPGD P15428 2/20 0.50
ACP3 P15309 1/20 0.50
HTT P42858 1/20 0.50
CA2 P00918 1/20 0.50
LOXL2 Q9Y4K0 1/20 0.48
HTR2A P28223 1/20 0.48
ALDH1A1 P00352 2/20 0.48
CYP3A4 P08684 1/20 0.48
TSHR P16473 1/20 0.48
KEAP1 Q14145 1/20 0.48
HSD17B10 Q99714 1/20 0.48
MTNR1A P48039 1/20 0.47
KDM4E B2RXH2 1/20 0.47
GAA P10253 1/20 0.47
MAPT P10636 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
SCHEMBL29484446 1.00 CYP1A2 (0.58) CYP1A2CYP2C19CYP2C9CYP2D6TDP1
Hydrochloric Acid SCHEMBL1922860 0.98 CYP1A2 (0.56) CYP1A2CYP2C19CYP2C9CYP2D6TDP1
Iodide SCHEMBL19990736 0.98 CYP1A2 (0.56) CYP1A2CYP2C19CYP2C9CYP2D6TDP1
Bromide SCHEMBL22401521 0.98 CYP1A2 (0.56) CYP1A2CYP2C19CYP2C9CYP2D6TDP1
Hydrochloric Acid SCHEMBL3665862 0.98 CYP1A2 (0.56) CYP1A2CYP2C19CYP2C9CYP2D6TDP1
Ammonia Solution, Strong SCHEMBL9173309 0.98 CYP1A2 (0.56) CYP1A2CYP2C19CYP2C9CYP2D6TDP1
SCHEMBL20593911 0.98 CYP1A2 (0.56) CYP1A2CYP2C19CYP2C9CYP2D6TDP1
Iodide SCHEMBL28994517 0.95 CYP1A2 (0.54) CYP1A2CYP2C19CYP2C9CYP2D6TDP1
Hydrochloric Acid SCHEMBL11771194 0.95 CYP1A2 (0.54) CYP1A2CYP2C19CYP2C9CYP2D6TDP1
Oxalic Acid SCHEMBL1922939 0.88 TDP1 (0.61) CYP1A2CYP2C19CYP2C9TDP1ACP3

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 3625 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4685176-A1 2-COMPONENT FOAMS BASED ON ACETYLACETONATE AND AMINES Henkel AG & Co. KGaA (DE) 2026-01-28 EP claimed
CN-116640319-B Organic chiral supermolecular gel based on 1-naphthylmethyl amine and application thereof in chiral recognition 常州大学 2025-05-27 CN claimed
CN-119977906-A A-site cation-regulated halide perovskite, and preparation method and application thereof 西北大学 2025-05-13 CN claimed
CN-114583553-B Method for preparing vertical cavity laser by perovskite film transfer 北京大学 2025-04-01 CN claimed
CN-119726347-A Non-external-cavity near-infrared perovskite laser and preparation method thereof 中国科学院半导体研究所 2025-03-28 CN claimed
CN-119726348-A Near-infrared perovskite laser and preparation method thereof 中国科学院半导体研究所 2025-03-28 CN claimed
WO-2025028509-A1 POLYMERIC MICELLE COMPRISING SINGLE POLYMER CHAIN OF SELF-AGGREGATING TYPE 国立大学法人東京工業大学 2025-02-06 WO claimed
CN-114539277-B 2,4,6, 8-Tetrasubstituted-2, 4,6, 8-tetraazanoradamantan-9-one ethylene glycol 南京理工大学 2024-11-29 CN claimed
CN-114539276-B 2,4,6, 8-Tetrasubstituted-2, 4,6, 8-tetraazaadamantane-9, 10-dione diethylene glycol 南京理工大学 2024-11-29 CN claimed
CN-118765910-A Biopesticide for preventing and treating fusarium wilt and preparation method thereof 内蒙古科技大学包头师范学院 2024-10-15 CN claimed
EP-0720982-A1 Benzimidazole derivatives, their production and use and use as angiotensin II antagonists TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-07-10 EP claimed
EP-0443568-B1 Fused thiophene derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1996-06-12 EP claimed
EP-0659746-A1 Process for the preparation of sulfonylaminocarbonyl-triazolinones BAYER AG (DE) 1995-06-28 EP claimed
EP-0445811-B1 Nitrogen-containing heterocyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1995-06-14 EP claimed
WO-1994028028-A1 TOPOLOGICALLY SEGREGATED, ENCODED SOLID PHASE LIBRARIES SELECTIDE CORPORATION (US) 1994-12-08 WO claimed
EP-0310122-B1 ANTIFUNGAL COMPOSITION KAKEN PHARMACEUTICAL CO., LTD. (JP) 1991-07-24 EP claimed
EP-0223157-B1 IMPROVED AUTOFLUOROGRAM COMPOSITION E.I. DU PONT DE NEMOURS AND COMPANY (US) 1990-01-31 EP claimed
US-4657993-A PREPARED FROM DICHLOROPHOSPHAZENES CONSIGLIO NAZIONALE DELLE RICERCHE (IT) 1987-04-14 US claimed
EP-0200854-A2 Phosphazene homopolymers and copolymers having hydroxylated or amino derivatives of carbazole or of naphthalene as substituents CONSIGLIO NAZIONALE DELLE RICERCHE (IT) 1986-12-17 EP claimed
US-4122089-A Aminothiofluoran compounds, process for the production thereof, and recording elements containing the same SANKIO CHEMICAL CO., LTD. (JP) 1978-10-24 US claimed