SCHEMBL648950

SCHEMBL648950

C=CC(=O)Nc1ccc(C)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 10/20 1.00
F13A1 P00488 1/20 0.66
LMNA P02545 1/20 0.66
TGM1 P22735 1/20 0.66
TGM3 Q08188 1/20 0.66
NMT1 P30419 1/20 0.61
DDAH1 O94760 1/20 0.59
TDP1 Q9NUW8 1/20 0.57
POLB P06746 1/20 0.55
MMP1 P03956 2/20 0.54
MMP2 P08253 2/20 0.54
MMP9 P14780 2/20 0.54
EGFR P00533 1/20 0.54
THRA P10827 1/20 0.54
THRB P10828 1/20 0.54
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
ALDH1A1 P00352 1/20 0.53

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
SCHEMBL8465028 0.94 TGM2 (0.89) TGM2F13A1LMNATGM1TGM3
SCHEMBL439369 0.89 TGM2 (0.79) TGM2F13A1LMNATGM1TGM3
SCHEMBL19457348 0.88 TGM2 (0.77) TGM2F13A1LMNATGM1TGM3
SCHEMBL17528641 0.85 TGM2 (0.73) TGM2F13A1LMNATGM1TGM3
SCHEMBL13581569 0.85 TGM2 (0.73) TGM2F13A1LMNATGM1TGM3
SCHEMBL11239798 0.85 TGM2 (0.73) TGM2F13A1LMNATGM1TGM3
SCHEMBL3821674 0.84 ALDH1A1 (0.71) TGM2LMNAPOLBALDH1A1
SCHEMBL9568792 0.84 ALDH1A1 (0.71) TGM2LMNAPOLBALDH1A1
SCHEMBL6358305 0.83 TGM2 (0.71) TGM2F13A1LMNATGM1TGM3
SCHEMBL15693010 0.83 TGM2 (0.71) TGM2F13A1LMNATGM1TGM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117800942-B Thiophene piperazine amide derivative, composition and application thereof 徐州医科大学 2025-04-25 CN claimed
CN-119744345-A Compositions and methods for single well multiple calibration and compensation 弹弓生物科学公司 2025-04-01 CN claimed
CN-118955381-A Pyrazole compound as well as preparation method and application thereof 赣南师范大学 2024-11-15 CN claimed
CN-117800942-A Thiophene piperazine amide derivative, composition and application thereof 徐州医科大学 2024-04-02 CN claimed
CN-115011172-A Ink capable of spraying and printing insulation structure 北京大华博科智能科技有限公司 2022-09-06 CN claimed
CN-111153826-B Synthesis method of 3-ethoxy-N-p-tolylpropionamide 常州大学 2021-07-30 CN claimed
CN-111153826-A Synthesis method of 3-ethoxy-N-p-tolylpropionamide 常州大学 2020-05-15 CN claimed
CN-103772713-B Graft modification polypropylene acid amides and preparation method thereof SINOPEC CORP. (CN) 2016-05-18 CN claimed
CN-103772713-A Graft-modified polyacrylamide and preparation method thereof CHINA PETROLEUM & CHEMICAL 2014-05-07 CN claimed
CN-102006873-B Methods of modulating the activity of the mc5 receptor and treatment of conditions related to this receptor MIMETICA PTY LTD 2013-09-18 CN claimed
JP-4828407-B2 2011-11-30 JP claimed
CN-102006873-A Methods of modulating the activity of the mc5 receptor and treatment of conditions related to this receptor MIMETICA PTY LTD 2011-04-06 CN claimed
CN-102007105-A 3-aminoalkyl-1, 4-diaza-2-one melanocortin-5 receptor antagonists MIMETICA PTY LTD 2011-04-06 CN claimed
EP-1594869-A2 3-SUBSTITUTED-2(ARYLALKYL)-1-AZABICYCLOALKANES AND METHODS OF USE THEREOF Targacept, Inc. (US) 2005-11-16 EP claimed
WO-2004076449-A2 3-SUBSTITUTED-2(ARYLALKYL)-1-AZABICYCLOALKANES AND METHODS OF USE THEREOF TARGACEPT, INC. (US) 2004-09-10 WO claimed
EP-0262796-B1 Resin compositons and their manufacturing method TORAY INDUSTRIES (JP) 1993-11-03 EP claimed
EP-0262796-A2 Resin compositons and their manufacturing method TORAY INDUSTRIES, INC. (JP) 1988-04-06 EP claimed
CN-117800942-B Thiophene piperazine amide derivative, composition and application thereof 徐州医科大学 2025-04-25 CN disclosed
US-3989882-A Process for preparing an alternating copolymer of a conjugated vinyl compound and an olefinic unsaturated compound SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-11-02 US disclosed
US-3936473-A COPPER OR NOBLE METAL SALT, OXYGEN AND ORGANIC ACID CATALYST UNIVERSAL OIL PRODUCTS COMPANY (US) 1976-02-03 US disclosed