SCHEMBL4937013

SCHEMBL4937013

NCC(CN)(c1ccccc1)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.56
KCNN4 O15554 1/20 0.48
KIF11 P52732 7/20 0.46
TSHR P16473 2/20 0.41
LOXL2 Q9Y4K0 2/20 0.41
ALDH1A1 P00352 1/20 0.41
HTR2A P28223 2/20 0.38
CYP2A6 P11509 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL2064836 0.85 TAAR1 (0.48) TAAR1KCNN4KIF11TSHRLOXL2
SCHEMBL2086206 0.85 TAAR1 (0.54) TAAR1KCNN4KIF11
SCHEMBL7460788 0.83 TAAR1 (0.46) TAAR1KCNN4KIF11
SCHEMBL9425766 0.83 TAAR1 (0.52) TAAR1KCNN4KIF11
SCHEMBL16636143 0.83 CYP1A2 (0.50) TAAR1KIF11LOXL2HTR2ACYP2A6
SCHEMBL28761433 0.83 TAAR1 (0.46) TAAR1KCNN4KIF11TSHRLOXL2
Hydrochloric Acid SCHEMBL9426177 0.81 TAAR1 (0.50) TAAR1KCNN4KIF11CYP2A6SMN1; SMN2
SCHEMBL8754636 0.81 TAAR1 (0.50) TAAR1KCNN4KIF11TSHRALDH1A1
SCHEMBL1220936 0.79 HTT (0.50) TAAR1KCNN4KIF11TSHRALDH1A1
SCHEMBL10346548 0.79 TAAR1 (0.54) TAAR1KCNN4KIF11ALDH1A1SMN1; SMN2

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116948199-A Preparation method of epoxy resin pressure-bearing plugging material and oil-based drilling fluid 西南石油大学 2023-10-27 CN disclosed
CN-101273083-B Method for improving the flowability of polymer melts CIBA HOLDING INC 2012-04-18 CN disclosed
US-7339009-B2 Cross-linked polyimide and method of making them GENERAL ELECTRIC COMPANY (US) 2008-03-04 US disclosed
US-20060135732-A1 Cross-linked polyimide and method of making them GENERAL ELECTRIC COMPANY 2006-06-22 US disclosed
CN-1060503-C Preparation of agent for orientation of polyimide for liquid crystal displayer CHANGCHUN APPLIED CHEMISTRY (CN) 2001-01-10 CN disclosed
CN-1201814-A Preparation of agent for orientation of polyimide for liquid crystal displayer CHANGCHUN APPLIED CHEMISTRY (CN) 1998-12-16 CN disclosed
EP-0361377-B1 Pervaporation method of separating liquid organic compound mixture through aromatic imide polymer asymmetric membrane UBE INDUSTRIES (JP) 1995-06-28 EP disclosed
US-4983655-A MOLDING MATERIALS SUNSTAR GIKEN KABUSHIKI KAISHA (JP) 1991-01-08 US disclosed
US-4981889-A SURFACE TREATED CURING AGENT SUNSTAR GIKEN KABUSHIKI KAISHA (JP) 1991-01-01 US disclosed
US-4959151-A Pervaporation method of separating liquid organic compound mixture through aromatic imide polymer asymmetric membrane UBE INDUSTRIES (JP) 1990-09-25 US disclosed
EP-0361377-A2 Pervaporation method of separating liquid organic compound mixture through aromatic imide polymer asymmetric membrane UBE INDUSTRIES, LTD. (JP) 1990-04-04 EP disclosed
EP-0193068-A1 One liquid type epoxy resin composition Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1986-09-03 EP disclosed
EP-0009640-B1 POLYPHOSPHAZENE POLYMERS CONTAINING CYCLIC SUBSTITUENTS FROM 1,2- OR 1,3-DIFUNCTIONAL COMPOUNDS AND PROCESS FOR PREPARING SAME THE FIRESTONE TIRE & RUBBER COMPANY (US) 1983-08-17 EP disclosed
US-4219637-A Polyphosphazene polymers containing cyclic substituents from 1,2- or 1,3-difunctional compounds THE FIRESTONE TIRE & RUBBER COMPANY (US) 1980-08-26 US disclosed
EP-0009640-A1 Polyphosphazene polymers containing cyclic substituents from 1,2- or 1,3-difunctional compounds and process for preparing same THE FIRESTONE TIRE & RUBBER COMPANY (US) 1980-04-16 EP disclosed