SCHEMBL6579135

SCHEMBL6579135

CCCCCCCCCCCC(CCC)N(N)N

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.42
PLA2G1B P04054 1/20 0.42
PLA2G2A P14555 1/20 0.42
SPHK1 Q9NYA1 2/20 0.40
LMNA P02545 2/20 0.39
DNM1 Q05193 3/20 0.39
TSHR P16473 1/20 0.38
THRB P10828 1/20 0.38
CYP2D6 P10635 2/20 0.38
GMNN O75496 1/20 0.38
POLB P06746 1/20 0.38
THPO P40225 1/20 0.38
MTOR P42345 1/20 0.38
BLM P54132 1/20 0.38
KDM4E B2RXH2 1/20 0.38
TP53 P04637 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
MAPT P10636 1/20 0.38
CETP P11597 1/20 0.38

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
SCHEMBL1685494 0.98 OPRM1 (0.44) OPRM1PLA2G1BPLA2G2ASPHK1LMNA
SCHEMBL8946581 0.86 OPRM1 (0.42) OPRM1PLA2G1BPLA2G2ASPHK1LMNA
SCHEMBL13067518 0.86 OPRM1 (0.42) OPRM1PLA2G1BPLA2G2ASPHK1LMNA
SCHEMBL6545348 0.85 PLA2G1B (0.34) PLA2G1BPLA2G2ADNM1
SCHEMBL532756 0.84 TSHR (0.30) TSHR
SCHEMBL28113967 0.78 LMNA (0.41) OPRM1PLA2G1BPLA2G2ALMNADNM1
SCHEMBL20219017 0.78 LMNA (0.41) OPRM1PLA2G1BPLA2G2ALMNADNM1
SCHEMBL11668627 0.78 LMNA (0.41) OPRM1PLA2G1BPLA2G2ALMNADNM1
SCHEMBL2839300 0.76 LMNA (0.44) PLA2G1BPLA2G2ASPHK1LMNADNM1
Hydrochloric Acid SCHEMBL8469058 0.76 DNM1 (0.42) OPRM1PLA2G1BPLA2G2ALMNADNM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1268603-B1 MANNICH BASES AND FURTHER COMPOUNDS BASED ON ALKYLDIPROPYLENETRIAMINES AS HARDENERS FOR EPOXY RESINS VANTICO GMBH & CO KG (DE) 2004-04-28 EP disclosed
US-6531567-B2 Hardeners for epoxy resins VANTICO GMBH & CO. (DE) 2003-03-11 US disclosed
EP-1268603-A2 MANNICH BASES AND FURTHER COMPOUNDS BASED ON ALKYLDIPROPYLENETRIAMINES AS HARDENERS FOR EPOXY RESINS Vantico GmbH & Co. KG (DE) 2003-01-02 EP disclosed
US-20010034409-A1 Mannich bases and further compounds based on alkyldipropylenetriamines VANTICO GMBH & CO. KG 2001-10-25 US disclosed
WO-2001072869-A2 MANNICH BASES AND FURTHER COMPOUNDS BASED ON ALKYLDIPROPYLENETRIAMINES AS HARDENERS FOR EPOXY RESINS VANTICO GMBH & CO. KG (DE) 2001-10-04 WO disclosed