SCHEMBL173965

SCHEMBL173965

C=CCC(c1ccccc1)N(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.49
CYP2C19 P33261 1/20 0.47
CHRNB2 P17787 1/20 0.42
CHRNB4 P30926 1/20 0.42
CHRNA3 P32297 1/20 0.42
CHRNA4 P43681 1/20 0.42
HTR2A P28223 3/20 0.42
HRH1 P35367 3/20 0.42
TDP1 Q9NUW8 1/20 0.41
OPRM1 P35372 1/20 0.40
OPRD1 P41143 1/20 0.40
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 2/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
ALOX15 P16050 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
AOC3 Q16853 2/20 0.37

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
Water SCHEMBL2110704 0.98 SMN1; SMN2 (0.48) SMN1; SMN2CYP2C19CHRNB2CHRNB4CHRNA3
Hydrochloric Acid SCHEMBL87594 0.98 SMN1; SMN2 (0.48) SMN1; SMN2CYP2C19CHRNB2CHRNB4CHRNA3
Iodide SCHEMBL29054398 0.98 SMN1; SMN2 (0.48) SMN1; SMN2CYP2C19CHRNB2CHRNB4CHRNA3
Bromide SCHEMBL1980740 0.98 SMN1; SMN2 (0.48) SMN1; SMN2CYP2C19CHRNB2CHRNB4CHRNA3
SCHEMBL15957167 0.83 CYP2C19 (0.50) SMN1; SMN2CYP2C19CHRNB2CHRNB4CHRNA3
SCHEMBL28259739 0.80 HTR2A (0.46) SMN1; SMN2CYP2C19HTR2AHRH1TDP1
SCHEMBL3825964 0.80 CHRNB2 (0.46) CHRNB2CHRNB4CHRNA3CHRNA4HTR2A
Bromide SCHEMBL25341355 0.79 SMN1; SMN2 (0.46) SMN1; SMN2CYP2C19HTR2AHRH1TDP1
SCHEMBL28501662 0.77 CHRNB2 (0.41) CYP2C19CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL27759532 0.77 CHRNB2 (0.41) CYP2C19CHRNB2CHRNB4CHRNA3CHRNA4

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 3085 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4225939-A1 METHOD FOR VIRUS DETECTION QIAGEN GmbH (DE) 2023-08-16 EP claimed
CN-112920491-B Preparation method of EPE environment-friendly packaging material 滁州天鸿新型包装材料有限公司 2023-06-27 CN claimed
CN-111628177-B Thinning negative current collector 合肥国轩高科动力能源有限公司 2022-07-05 CN claimed
US-11236265-B2 Multi-functional surfactant solution for improving hydrocarbon recovery Alchemy Sciences, Inc. (US) 2022-02-01 US claimed
CN-113301802-A Synergistic preservative compositions, methods of making and methods of using the same ISP投资有限公司 2021-08-24 CN claimed
US-20210253942-A1 CHEMICAL ADDITIVES AND SURFACTANT COMBINATIONS FOR FAVORABLE ALTERATION OF HYDROCARBON PROPERTIES AND IMPROVED HYDROCARBON RECOVERY FACTORS Alchemy Sciences, Inc. 2021-08-19 US claimed
CN-112920491-A Preparation method of EPE environment-friendly packaging material 杨辉 2021-06-08 CN claimed
US-20210002543-A1 MULTI-FUNCTIONAL SURFACTANT SOLUTION FOR IMPROVING HYDROCARBON RECOVERY ALCHEMY SCIENCES INC (US) 2021-01-07 US claimed
US-10815416-B2 Multi-functional surfactant solution for improving hydrocarbon recovery Alchemy Sciences, Inc. (US) 2020-10-27 US claimed
CN-111628177-A Thinning negative current collector 合肥国轩高科动力能源有限公司 2020-09-04 CN claimed
WO-2000002449-A1 PROCESS FOR THE BIOCIDAL TREATMENT OF SURFACES RHODIA CHIMIE (FR) 2000-01-20 WO claimed
US-5728822-A ISOLATING RNA FROM BLOOD QIAGEN N.V. (NL) 1998-03-17 US claimed
WO-1995005183-A1 ANTIMICROBIAL BARRIER COMPOSITION INTERNATIONAL LABORATORY TECHNOLOGY CORPORATION (US) 1995-02-23 WO claimed
US-5266103-A Printed circuits C. UYEMURA & CO., LTD. (JP) 1993-11-30 US claimed
EP-0231573-B1 IMPROVED IONIC HEPARIN COATING BAXTER INTERNATIONAL INC. (a Delaware corporation) (US) 1991-11-06 EP claimed
US-5010183-A Process for purifying DNA and RNA using cationic detergents QIAGEN N.V. (NL) 1991-04-23 US claimed
US-4871357-A COMPLEX WITH ALKYLBENZYLDIMETHYLAMMONIUM ION; ANTITHROMBOGENIC BAXTER INTERNATIONAL INC. (US) 1989-10-03 US claimed
EP-0231573-A2 Improved ionic heparin coating BAXTER INTERNATIONAL INC. (a Delaware corporation) (US) 1987-08-12 EP claimed
US-4226672-A TREATING WITH SURFACTANT, FIBERIZING, DILUTING, CLASSIFYING, AGGLOMERATING, DEWATERING ICI AUSTRALIA LIMITED (AU) 1980-10-07 US claimed
US-4190456-A DISPERSION, AGGLOMERIZATION ICI AUSTRALIA LIMITED (AU) 1980-02-26 US claimed