SCHEMBL2145456

SCHEMBL2145456

C=C(C)CC1CC=CCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.39
ALDH1A1 P00352 7/20 0.39
PKM P14618 1/20 0.39
TDP1 Q9NUW8 3/20 0.35
ALOX15 P16050 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MEN1 O00255 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
GAA P10253 2/20 0.31
POLB P06746 2/20 0.31
MAPK1 P28482 1/20 0.30
CDK1 P06493 1/20 0.30
CCNB1 P14635 1/20 0.30
CCNA2 P20248 1/20 0.30
CDK2 P24941 1/20 0.30
CCNA1 P78396 1/20 0.30

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
SCHEMBL66706 0.83 KDM4E (0.37) KDM4EALDH1A1PKMTDP1ALOX15
SCHEMBL11456470 0.79 KDM4E (0.36) KDM4EALDH1A1PKMTDP1ALOX15
SCHEMBL2690835 0.79 KDM4E (0.42) KDM4EALDH1A1PKMTDP1HSD17B10
SCHEMBL5271233 0.76 KDM4E (0.37) KDM4EALDH1A1PKMTDP1ALOX15
SCHEMBL19695304 0.76 MAPK1 (0.41) KDM4EALDH1A1PKMTDP1HSD17B10
SCHEMBL19695484 0.76 MAPK1 (0.41) KDM4EALDH1A1PKMTDP1HSD17B10
Acetic Acid SCHEMBL16498836 0.75 KDM4E (0.41) KDM4EALDH1A1PKMTDP1HSD17B10
SCHEMBL92858 0.72 KDM4E (0.43) KDM4EALDH1A1PKMTDP1HSD17B10
SCHEMBL22587458 0.72 KDM4E (0.43) KDM4EALDH1A1PKMTDP1HSD17B10
Methacrylic Acid SCHEMBL5864223 0.72 KDM4E (0.43) KDM4EALDH1A1PKMTDP1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0683812-A1 CLEANING ROGERS, Neil (GB) 1995-11-29 EP claimed
WO-1994018300-A2 CLEANING ROGERS NEIL (GB) 1994-08-18 WO claimed
EP-4121760-A1 SYSTEMS AND METHODS FOR NON-INVASIVE DETERMINATION OF COVID-19 CORONAVIRUS INFECTION Terahertz Group Ltd. (IL) 2023-01-25 EP disclosed
EP-3898734-A1 HIGH REFRACTIVE INDEX COMPOSITIONS AND USES THEREOF PPG Industries Ohio Inc. (US) 2021-10-27 EP disclosed
WO-2021186412-A1 SYSTEMS AND METHODS FOR NON-INVASIVE DETERMINATION OF COVID-19 CORONAVIRUS INFECTION Terahertz Group Ltd. (IL) 2021-09-23 WO disclosed
EP-3860350-A1 TERMITE REPELLENT AND WOOD PROTECTOR d'Amico, Biljana Milankovic (US) 2021-08-11 EP disclosed
WO-2020131786-A1 HIGH REFRACTIVE INDEX COMPOSITIONS AND USES THEREOF PPG INDUSTRIES OHIO, INC. (US) 2020-06-25 WO disclosed
EP-3459352-A1 SYNERGISTIC PEST-CONTROL COMPOSITIONS TyraTech, Inc. (US) 2019-03-27 EP disclosed
EP-2975943-A2 LICE CONTROL COMPOSITION AND METHOD Tyratech, Inc. (US) 2016-01-27 EP disclosed
EP-2908648-A1 ARTHROPOD CONTROL COMPOSITIONS AND METHODS Tyratech, Inc. (US) 2015-08-26 EP disclosed
WO-2014149138-A2 LICE CONTROL COMPOSITION AND METHOD TYRATECH INC. (US) 2014-09-25 WO disclosed
WO-1998048625-A1 ANT SPRAY CONTAINING D-LIMONENE AND METHODS OF MAKING AND USING SAME MCPARTLAND TOR (US) 1998-11-05 WO disclosed
EP-0631639-A4 PROCESS AND COMPOSITIONS FOR DYEING HYDROPHOBIC POLYMER PRODUCTS. ARROW ENG INC (US) 1998-04-29 EP disclosed
EP-0683812-A1 CLEANING ROGERS, Neil (GB) 1995-11-29 EP disclosed
EP-0631639-A1 PROCESS AND COMPOSITIONS FOR DYEING HYDROPHOBIC POLYMER PRODUCTS ARROW ENGINEERING, INC. (US) 1995-01-04 EP disclosed
WO-1994018300-A2 CLEANING ROGERS NEIL (GB) 1994-08-18 WO disclosed
WO-1993017166-A1 PROCESS AND COMPOSITIONS FOR DYEING HYDROPHOBIC POLYMER PRODUCTS ARROW ENGINEERING, INC. (US) 1993-09-02 WO disclosed
EP-0100479-B1 3-(AMINOMETHYL)-1-(3-AMINOPROPYL-1-METHYL)-4-METHYL CYCLOHEXANE, PROCESS FOR ITS PREPARATION AND ITS USE BAYER AG (DE) 1985-03-13 EP disclosed
US-4487966-A 3-Aminomethyl-1-(3-aminopropyl-1-methyl)-4-methylcyclohexane, a process for its preparation and its use BAYER AKTIENGESELLSCHAFT (DE) 1984-12-11 US disclosed
EP-0100479-A1 3-(Aminomethyl)-1-(3-aminopropyl-1-methyl)-4-methyl cyclohexane, process for its preparation and its use BAYER AG (DE) 1984-02-15 EP disclosed