SCHEMBL622659

SCHEMBL622659

CCC(C#N)c1ccccc1N

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.38
TSHR P16473 3/20 0.34
CYP3A4 P08684 4/20 0.33
ALOX15 P16050 1/20 0.33
CASP1 P29466 1/20 0.33
CASP7 P55210 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAP2K1 Q02750 1/20 0.33
RPS27 P42677 1/20 0.32
MAPK8 P45983 1/20 0.32
CTSC P53634 2/20 0.32
CYP1A2 P05177 2/20 0.32
CYP2C9 P11712 2/20 0.32
CYP2C19 P33261 2/20 0.32
TDP1 Q9NUW8 1/20 0.31
HSD17B10 Q99714 2/20 0.30
HPGD P15428 1/20 0.30
KEAP1 Q14145 1/20 0.30
CRHR1 P34998 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL16486495 0.82 CYP1A2 (0.39) ALDH1A1CYP3A4CASP1CASP7CYP1A2
SCHEMBL8646951 0.78 TSHR (0.35) ALDH1A1TSHRALOX15SMN1; SMN2CYP1A2
SCHEMBL14098356 0.77 CCR1 (0.39) ALDH1A1TSHRCYP3A4ALOX15CYP1A2
SCHEMBL1461172 0.77 TSHR (0.34) ALDH1A1TSHR
SCHEMBL954150 0.77 CCR1 (0.39) ALDH1A1TSHRCYP3A4CYP2C9TDP1
SCHEMBL5860173 0.77 ALDH1A1 (0.42) ALDH1A1TSHRCYP3A4CASP1CYP2C9
SCHEMBL29061986 0.77 CCR1 (0.39) ALDH1A1TSHRCYP3A4CYP2C9TDP1
SCHEMBL17434454 0.77 L3MBTL1 (0.45) ALDH1A1TSHRSMN1; SMN2CYP1A2CYP2C9
SCHEMBL2554095 0.77 TSHR (0.57) ALDH1A1TSHRCYP3A4ALOX15SMN1; SMN2
SCHEMBL6746613 0.77 TSHR (0.32) TSHRCTSC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009073570-A2 LIGHT- AND DUAL-CURE DENTAL RESINS AND ADHESIVES WITH INCREASED CURE AND COLOR-STABILITY, AND LOW COLOR BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2009-06-11 WO claimed
US-20250297044-A1 RADIATION-CURABLE COMPOSITION FOR USE IN A RAPID PROTOTYPING PROCESS OR A RAPID MANUFACTURING PROCESS KULZER GMBH (DE) 2025-09-25 US disclosed
EP-4518794-A1 RADIATION-CURABLE COMPOSITION FOR USE IN A RAPID PROTOTYPING PROCESS OR A RAPID MANUFACTURING PROCESS Kulzer GmbH (DE) 2025-03-12 EP disclosed
EP-3689290-B1 METHOD FOR PRODUCING A PARTIAL OR TOTAL PROSTHESIS, AND PROSTHESIS OBTAINABLE BY THIS METHOD KULZER & CO GMBH (DE) 2023-11-22 EP disclosed
WO-2023213699-A1 RADIATION-CURABLE COMPOSITION FOR USE IN A RAPID PROTOTYPING PROCESS OR A RAPID MANUFACTURING PROCESS KULZER GMBH (DE) 2023-11-09 WO disclosed
CN-115943053-A Radiation curable compositions for rapid prototyping or rapid manufacturing processes 古莎有限公司 2023-04-07 CN disclosed
EP-4122422-A1 RADIATION-CURABLE COMPOSITION FOR USE IN RAPID PROTOTYPING OR RAPID MANUFACTURING METHODS Kulzer GmbH (DE) 2023-01-25 EP disclosed
EP-4039223-A1 RADIATION-CURABLE COMPOSITION FOR USE IN RAPID PROTOTYPING OR RAPID MANUFACTURING METHODS Kulzer GmbH (DE) 2022-08-10 EP disclosed
EP-3164097-B1 MILL BLANKS BASED ON A POLYMERIZED, FRACTURE-TOUGH PROSTHESIS MATERIAL KULZER & CO GMBH (DE) 2022-05-11 EP disclosed
US-11273018-B2 Multi-coloured milling blank for implant-supported dental prosthetic restorations KULZER GMBH (DE) 2022-03-15 US disclosed
EP-0475239-A2 Polymerizable dental material IVOCLAR AG (LI) 1992-03-18 EP disclosed
US-5095045-A PLASTICS WHICH CURE IN A SERIES OF STEPS HAVING URETHANE, UREA, SILOXANE AND ACRYLATE GROUPS BAYER AKTIENGESELLSCHAFT (DE) 1992-03-10 US disclosed
EP-0460478-A2 Light hardenable impression materials BAYER AG (DE) 1991-12-11 EP disclosed
EP-0449399-A2 Polymerizable dental composition IVOCLAR AG (LI) 1991-10-02 EP disclosed
EP-0195224-B1 PROCESS FOR PREPARING ARTIFICIAL TEETH OR TOOTH PARTS AND STORAGE-STABLE DENTAL MATERIAL SUITED THEREFOR Etablissement Dentaire IVOCLAR (LI) 1990-09-26 EP disclosed
EP-0189540-B1 X-RAY OPAQUE DENTAL MATERIAL Etablissement Dentaire IVOCLAR (LI) 1990-06-13 EP disclosed
EP-0262488-B1 REACTIVE ORGANIC FILLER AND ITS USE Ivoclar AG (LI) 1990-06-06 EP disclosed
EP-0262488-A1 Reactive organic filler and its use Ivoclar AG (LI) 1988-04-06 EP disclosed
EP-0195224-A2 Process for preparing artificial teeth or tooth parts and storage-stable dental material suited therefor Etablissement Dentaire IVOCLAR (LI) 1986-09-24 EP disclosed
EP-0189540-A2 X-ray opaque dental material Etablissement Dentaire IVOCLAR (LI) 1986-08-06 EP disclosed