SCHEMBL7830818

SCHEMBL7830818

C[CH]CCN1CCCCC1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.48
MAPT P10636 3/20 0.44
ALDH1A1 P00352 3/20 0.44
POLB P06746 1/20 0.44
CYP1A2 P05177 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CARM1 Q86X55 1/20 0.42
PRMT6 Q96LA8 1/20 0.42
PRMT8 Q9NR22 1/20 0.42
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CHRM5 P08912 1/20 0.37
ADRA2C P18825 1/20 0.37
LMNA P02545 1/20 0.37
ALOX15 P16050 1/20 0.36
SIGMAR1 Q99720 1/20 0.35
TSHR P16473 1/20 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
SCHEMBL10379098 0.97
SCHEMBL16676782 0.82 CARM1 (0.41) HRH3MAPTALDH1A1POLBCYP1A2
SCHEMBL28717804 0.79 SIGMAR1 (0.47) MAPTALDH1A1CYP1A2LMNAALOX15
SCHEMBL11179141 0.78 HRH3 (0.52) HRH3MAPTALDH1A1POLBCYP1A2
SCHEMBL5489927 0.78 HRH3 (0.52) HRH3MAPTALDH1A1POLBCYP1A2
SCHEMBL524469 0.75 GLA (0.47) HRH3MAPTALDH1A1POLBCYP1A2
SCHEMBL1134897 0.75 SMN1; SMN2 (0.45) MAPTALDH1A1POLBSMN1; SMN2LMNA
SCHEMBL15658696 0.75 HRH3 (0.44) HRH3MAPTALDH1A1POLBCYP1A2
SCHEMBL2501227 0.75 HRH3 (0.39) HRH3MAPTALDH1A1POLBCYP1A2
SCHEMBL10846103 0.75 HRH3 (0.48) HRH3MAPTALDH1A1POLBCYP1A2

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104768962-A Platinum compound of malonic acid derivative having leaving group containing amino or alkylamino BEIJING FSWELCOME TECHNOLOGY DEV CO LTD 2015-07-08 CN disclosed
EP-1114033-A1 4-CARBOXYAMINO-2-METHYL-1,2,3,4-TETRAHYDROQUINOLINES AS CETP INHIBITORS Pfizer Products Inc. (US) 2001-07-11 EP disclosed
WO-2000017166-A1 4-CARBOXYAMINO-2-METHYL-1,2,3,4-TETRAHYDROQUINOLINES AS CETP INHIBITORS PFIZER PRODUCTS INC. (US) 2000-03-30 WO disclosed
US-4895587-A Haloacetamide compounds, process for production thereof, and use thereof as herbicide TOKUYAMA SODA KABUSHIKI KAISHA (JP) 1990-01-23 US disclosed
EP-0206251-B1 HALOACETAMIDE COMPOUNDS, PROCESS FOR PRODUCTION THEREOF, AND USE THEREOF AS HERBICIDE TOKUYAMA SODA KABUSHIKI KAISHA (JP) 1988-09-07 EP disclosed
EP-0206251-A1 Haloacetamide compounds, process for production thereof, and use thereof as herbicide TOKUYAMA SODA KABUSHIKI KAISHA (JP) 1986-12-30 EP disclosed
EP-0072620-B1 3-METHYLFLAVONE-8-CARBOXYLIC ACID ESTERS RECORDATI S.A. CHEMICAL and PHARMACEUTICAL COMPANY (CH) 1985-12-04 EP disclosed
US-4550115-A ANTISPASMODIC, CALCIUM BLOCKER, ANESTHETIC, AND ANTINFLAMMATORY AG RECORDATI S.A., CHEMICAL & PHARMACEUTICAL COMPANY (CH) 1985-10-29 US disclosed
EP-0072620-A1 3-Methylflavone-8-carboxylic acid esters RECORDATI S.A. CHEMICAL and PHARMACEUTICAL COMPANY (CH) 1983-02-23 EP disclosed