SCHEMBL2199869

SCHEMBL2199869

NCC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.94

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 15/20 0.58
TAAR1 Q96RJ0 1/20 0.56
KCNN4 O15554 1/20 0.48
KCNH2 Q12809 2/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42

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
Bromide SCHEMBL28902280 0.97 KIF11 (0.56) KIF11TAAR1KCNN4KCNH2CYP3A4
Hydrochloric Acid SCHEMBL11784205 0.97 KIF11 (0.56) KIF11TAAR1KCNN4KCNH2CYP3A4
Water SCHEMBL11128723 0.97 KIF11 (0.56) KIF11TAAR1KCNN4KCNH2CYP3A4
Phosphine SCHEMBL28505015 0.97 KIF11 (0.56) KIF11TAAR1KCNN4KCNH2CYP3A4
SCHEMBL22509269 0.86 KCNN4 (0.50) KIF11TAAR1KCNN4KCNH2
SCHEMBL17964412 0.81 KIF11 (0.70) KIF11TAAR1KCNH2
SCHEMBL453396 0.78 TAAR1 (0.52) KIF11TAAR1KCNN4KCNH2CYP3A4
SCHEMBL3414508 0.78 KIF11 (0.74) KIF11TAAR1KCNN4KCNH2CYP3A4
SCHEMBL4937013 0.77 TAAR1 (0.56) KIF11TAAR1KCNN4
SCHEMBL150158 0.77 TAAR1 (0.56) KIF11TAAR1KCNN4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120019057-A Cucurbiturils compound and medical application thereof 上海森辉医药有限公司 2025-05-16 CN claimed
CN-119907921-A Engineered particles as red blood cell mimics for hematology and compositions containing the same 弹弓生物科学公司 2025-04-29 CN claimed
CN-117821969-A Polymer brush-based bionic super-slip coating and preparation method and application thereof 中国科学院宁波材料技术与工程研究所 2024-04-05 CN claimed
CN-120019057-A Cucurbiturils compound and medical application thereof 上海森辉医药有限公司 2025-05-16 CN disclosed
CN-118547298-A Method for electrochemical reduction of aryl alkene and alkyne 中国科学院大连化学物理研究所 2024-08-27 CN disclosed
CN-118355112-A Hydrogel particles as feeder cells and as synthetic antigen presenting cells 弹弓生物科学公司 2024-07-16 CN disclosed
CN-117821969-A Polymer brush-based bionic super-slip coating and preparation method and application thereof 中国科学院宁波材料技术与工程研究所 2024-04-05 CN disclosed
CN-113045968-B Polymers, methods, compositions and uses 科思创(荷兰)有限公司 2022-10-21 CN disclosed
CN-112961331-B Polymers, methods, compositions and uses 科思创(荷兰)有限公司 2022-10-21 CN disclosed
EP-2721104-B1 RADIATION CURABLE POLY(ISOBUTYLENE) ADHESIVE COPOLYMERS HAVING PENDENT AMINE GROUPS 3M INNOVATIVE PROPERTIES CO (US) 2016-01-06 EP disclosed
EP-2721104-A1 RADIATION CURABLE POLY(ISOBUTYLENE) ADHESIVE COPOLYMERS HAVING PENDENT AMINE GROUPS 3M Innovative Properties Company (US) 2014-04-23 EP disclosed
US-4431571-A ORGANOALUMINUM COMPOUND, REACTION PRODUCT OF TITANIUM HALIDE, ELEC STANDARD OIL COMPANY (INDIANA) (US) 1984-02-14 US disclosed
US-4431572-A ORGANOALUMINUM COMPOUND, THE REACTION PRODUCT OF A TITANIUM HALIDE STANDARD OIL COMPANY (INDIANA) (US) 1984-02-14 US disclosed
US-4431570-A ORGANOALUMINUM COMPOUND, REACTION PRODUCT OF TITANIUM HALIDE, ELECTRON DONOR AND MAGNESIUM COMPOUND; CATALYST SUPPORTS STANDARD OIL COMPANY (INDIANA) (US) 1984-02-14 US disclosed
EP-0095290-A1 Retreating comminuted olefin polymerization catalyst with a titanium (IV) compound and an ester AMOCO CORPORATION (US) 1983-11-30 EP disclosed
US-4353813-A STEREOSPECIFIC COORDINATION CATALYST TREATED WIH HALOGENATED HYDROCARBON STANDARD OIL COMPANY (INDIANA) (US) 1982-10-12 US disclosed
US-4324690-A STEREOSPECIFIC;ORGANOALUMINUM COMPONENT AND COORDINATION CATALYST CONTAINING TITANIUM AND MAGNESIUM STANDARD OIL COMPANY (INDIANA) (US) 1982-04-13 US disclosed
US-4308169-A TREATMENT WITH AQUEOUS SOLUTION OF QUATERNARY AMMONIUM COMPOUND AND LINEAR IONIC COMPOUND UOP INC. (US) 1981-12-29 US disclosed
US-4277370-A COORDINATION CATALYSTS STANDARD OIL COMPANY (INDIANA) (US) 1981-07-07 US disclosed
EP-0015645-A1 Alpha-olefin polymerization catalyst, process for producing catalyst component and process for polymerizing alpha-olefins Standard Oil Company (US) 1980-09-17 EP disclosed