SCHEMBL49477

SCHEMBL49477

CC(C)c1ccc(N)cc1N

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 4/20 0.48
ANPEP P15144 1/20 0.40
ALDH1A1 P00352 6/20 0.39
CYP3A4 P08684 4/20 0.37
HSD17B10 Q99714 1/20 0.37
TRPA1 O75762 1/20 0.37
LMNA P02545 1/20 0.37
CHRM1 P11229 1/20 0.37
SLC6A2 P23975 1/20 0.37
ADRA1A P35348 1/20 0.37
HTR2B P41595 1/20 0.37
GAA P10253 4/20 0.35
TSHR P16473 3/20 0.35
HTT P42858 2/20 0.35
ALOX12 P18054 1/20 0.35
HIF1A Q16665 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
POLB P06746 3/20 0.35
MEN1 O00255 3/20 0.35
MAPT P10636 3/20 0.35

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
SCHEMBL29368425 1.00 CASP1 (0.48) CASP1ANPEPALDH1A1CYP3A4HSD17B10
SCHEMBL5486247 1.00 CASP1 (0.48) CASP1ANPEPALDH1A1CYP3A4HSD17B10
Hydrochloric Acid SCHEMBL11217552 0.98 CASP1 (0.46) CASP1ANPEPALDH1A1CYP3A4HSD17B10
Isopropylbenzene SCHEMBL28478258 0.86 ALDH1A1 (0.38) CASP1ANPEPALDH1A1CYP3A4HSD17B10
SCHEMBL30102587 0.82 ANPEP (0.41) CASP1ANPEPALDH1A1CYP3A4HSD17B10
SCHEMBL2379856 0.82 ANPEP (0.41) CASP1ANPEPALDH1A1CYP3A4HSD17B10
SCHEMBL17385275 0.81 CASP1 (0.44) CASP1ALDH1A1CYP3A4HSD17B10GAA
SCHEMBL28710669 0.81 CASP1 (0.44) CASP1ANPEPALDH1A1CYP3A4GAA
SCHEMBL213570 0.81 CASP1 (0.44) CASP1ALDH1A1CYP3A4HSD17B10GAA
SCHEMBL27780867 0.81 CASP1 (0.44) CASP1ANPEPALDH1A1CYP3A4HSD17B10

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 2614 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11905381-B2 Polyimide microparticles XEROX CORPORATION (US) 2024-02-20 US claimed
US-20230143643-A1 LOW DK COPPER CLAD LAMINATE COMPOSITIONS DESIGNER MOLECULES INC (US) 2023-05-11 US claimed
US-20230095931-A1 UV-CURABLE RESIN COMPOSITIONS SUITABLE FOR REDISTRIBUTION LAYERS DESIGNER MOLECULES INC (US) 2023-03-30 US claimed
EP-4097756-A2 UV-CURABLE RESIN COMPOSITIONS SUITABLE FOR REDISTRIBUTION LAYERS Designer Molecules, Inc. (US) 2022-12-07 EP claimed
US-20220363843-A1 POLYIMIDE MICROPARTICLES XEROX CORPORATION (US) 2022-11-17 US claimed
EP-4089136-A1 POLYIMIDE MICROPARTICLES Xerox Corporation (US) 2022-11-16 EP claimed
CN-115322398-A Polyimide fine particles 施乐公司 2022-11-11 CN claimed
US-20220204766-A1 HIGH MOLECULAR WEIGHT FLEXIBLE CURABLE POLYIMIDES DESIGNER MOLECULES, INC 2022-06-30 US claimed
US-20220204696-A1 PHENOLIC FUNCTIONALIZED POLYIMIDES AND COMPOSITIONS THEREOF DESIGNER MOLECULES, INC 2022-06-30 US claimed
US-20210301133-A1 CURABLE POLYIMIDES DESIGNER MOLECULES INC (US) 2021-09-30 US claimed
US-5241039-A Polyimide/aliphatic polyester copolymers without pendent carboxylic acid groups (C-2662) EXXON RESEARCH & ENGINEERING COMPANY (US) 1993-08-31 US claimed
US-5132396-A Phthalonitrile monomers containing imide and/or phenoxy linkages, and polymers thereof THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1992-07-21 US claimed
US-5093003-A Separation of aromatic from saturated hydrocarbons by semipermeable membrane EXXON RESEARCH AND ENGINEERING COMPANY (US) 1992-03-03 US claimed
US-5028685-A Polyesterurethanes, hard and soft segments, membranes for separation of aromatics from saturates EXXON RESEARCH & ENGINEERING COMPANY (US) 1991-07-02 US claimed
EP-0424041-A2 Membranes obtained from copolymers of polyimides and aliphatic polyesters. EXXON RESEARCH AND ENGINEERING COMPANY (US) 1991-04-24 EP claimed
US-4990275-A Separation membrane EXXON RESEARCH AND ENGINEERING COMPANY (US) 1991-02-05 US claimed
US-4944880-A FOR SEPARATION OF AROMATIC AND NON-AROMATIC HYDROCARBONS EXXON RESEARCH AND ENGINEERING COMPANY (US) 1990-07-31 US claimed
US-4324553-A OXIDATION COLOR DYES L'OREAL (FR) 1982-04-13 US claimed
US-RE30351-E Aromatic polyimide, polyester and polyamide separation membranes E. I. DU PONT DE NEMOURS AND COMPANY (US) 1980-07-29 US claimed
US-4107151-A FROM POLYISOCYANATE, CHAIN POLYOL, AROMATIC DIAMINE, POLYOL OR AMINO ALCOHOL WITH URETHANE BOND IHARA CHEMICAL COMPANY CO., LTD. (JP) 1978-08-15 US claimed