SCHEMBL3280867

SCHEMBL3280867

C=Cc1ccc(CNCC)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
LMNA P02545 1/20 0.39
HRH4 Q9H3N8 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
TAS1R3 Q7RTX0 1/20 0.37
TAS1R1 Q7RTX1 1/20 0.37
TP53 P04637 2/20 0.36
CHRNB2 P17787 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
CHRNA7 P36544 1/20 0.36
CHRNA4 P43681 1/20 0.36
TSHR P16473 1/20 0.36
HDAC8 Q9BY41 3/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PARP1 P09874 1/20 0.35
MAPT P10636 1/20 0.34
CHRM2 P08172 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CYP1A2 P05177 1/20 0.34

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
SCHEMBL11146572 0.87 ALDH1A1 (0.55) ALDH1A1LMNATP53TSHRHDAC8
Styrene SCHEMBL10628603 0.86 ALDH1A1 (0.52) ALDH1A1TP53TSHRMAPTCHRM2
SCHEMBL15927522 0.84 HRH4 (0.47) ALDH1A1LMNAHRH4HRH3TAS1R3
SCHEMBL3386247 0.84 L3MBTL1 (0.36) ALDH1A1LMNATP53HDAC8L3MBTL1
Diethylamine SCHEMBL93913 0.83 ALDH1A1 (0.46) ALDH1A1LMNATAS1R3TAS1R1TP53
SCHEMBL4159439 0.83 ALDH1A1 (0.50) ALDH1A1HRH4HRH3TSHRHDAC8
SCHEMBL9180552 0.82 LMNA (0.52) ALDH1A1LMNAHRH4HRH3TP53
SCHEMBL14732597 0.81 HRH4 (0.58) LMNAHRH4HRH3SMN1; SMN2CHRM2
SCHEMBL6207304 0.81 ALDH1A1 (0.47) ALDH1A1LMNAHRH4HRH3HDAC8
Hydrochloric Acid SCHEMBL7047762 0.81 MEN1 (0.48) ALDH1A1LMNAHRH4HRH3TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9783671-B2 Cross-linked plastic material with an intrinsic antimicrobial effect based on unsaturated polyesters Fachhochschule Münster (DE) 2017-10-10 US claimed
US-20060181587-A1 Ink set and media for ink-jet printing HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. 2006-08-17 US claimed
US-9803091-B2 Cross-linked plastic material with an intrinsic antimicrobial effect based on vinyl esters and vinyl ester urethanes Fachhochschule Münster (DE) 2017-10-31 US disclosed
US-9803091-B2 Cross-linked plastic material with an intrinsic antimicrobial effect based on vinyl esters and vinyl ester urethanes Fachhochschule Münster (DE) 2017-10-31 US disclosed
US-9803091-B2 Cross-linked plastic material with an intrinsic antimicrobial effect based on vinyl esters and vinyl ester urethanes Fachhochschule Münster (DE) 2017-10-31 US disclosed
US-9783671-B2 Cross-linked plastic material with an intrinsic antimicrobial effect based on unsaturated polyesters Fachhochschule Münster (DE) 2017-10-10 US disclosed
US-9783671-B2 Cross-linked plastic material with an intrinsic antimicrobial effect based on unsaturated polyesters Fachhochschule Münster (DE) 2017-10-10 US disclosed
US-9783671-B2 Cross-linked plastic material with an intrinsic antimicrobial effect based on unsaturated polyesters Fachhochschule Münster (DE) 2017-10-10 US disclosed
EP-2951245-B1 CROSSLINKED PLASTIC MATERIAL WITH INTRINSIC ANTIMICROBIAL EFFECT ON THE BASIS OF UNSATURATED POLYESTER Fachhochschule Münster (DE) 2017-08-02 EP disclosed
EP-2951245-B1 CROSSLINKED PLASTIC MATERIAL WITH INTRINSIC ANTIMICROBIAL EFFECT ON THE BASIS OF UNSATURATED POLYESTER Fachhochschule Münster (DE) 2017-08-02 EP disclosed
EP-2951243-B1 CROSSLINKED PLASTIC MATERIAL WITH INTRINSICALLY ANTIMICROBIAL EFFECT BASED ON VINYL ESTERS AND VINYL ESTERURETHANES Fachhochschule Münster (DE) 2017-03-08 EP disclosed
EP-0988152-A1 COATING COMPOSITION AND PRINTING MEDIUM PPG Industries Ohio, Inc. (US) 2000-03-29 EP disclosed
EP-0988154-A1 COATING COMPOSITION AND PRINTING MEDIUM PPG Industries Ohio, Inc. (US) 2000-03-29 EP disclosed
US-5880196-A VOLATILE AQUEOUS LIQUID MEDIUM CONTAINING ONIUM-FREE AND ONIUM-CONTAINING POLYMERIC BINDERS, FINELY DIVIDED PSEUDOBOEHMITE PARTICLES; NONBLEEDING PPG INDUSTRIES, INC. (US) 1999-03-09 US disclosed
WO-1998056592-A1 COATING COMPOSITION AND PRINTING MEDIUM PPG INDUSTRIES OHIO, INC. (US) 1998-12-17 WO disclosed
WO-1998056591-A1 COATING COMPOSITION AND PRINTING MEDIUM PPG INDUSTRIES OHIO, INC. (US) 1998-12-17 WO disclosed
EP-0376751-B1 Polymerizable cyclic urea derivatives and polymers having a pendant urea NIPPON PAINT CO LTD (JP) 1995-02-08 EP disclosed
US-5179184-A Polymerizable cyclic urea derivatives and polymers having a pendant urea NIPPON PAINT CO., LTD. (JP) 1993-01-12 US disclosed
US-5030726-A Polymerizable cyclic urea derivatives NIPPON PAINT CO., LTD. (JP) 1991-07-09 US disclosed
EP-0376751-A1 Polymerizable cyclic urea derivatives and polymers having a pendant urea NIPPON PAINT CO., LTD. (JP) 1990-07-04 EP disclosed