SCHEMBL9549482

SCHEMBL9549482

CCCCCCCCCCCCCCCCCC(=O)NCCCN(CC)CCCCCCCCCC

nearest known ligand 0.71

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.71
FAAH O00519 5/20 0.62
NAAA Q02083 1/20 0.59
CASP2 P42575 1/20 0.58
EPHX2 P34913 3/20 0.51
SELP P16109 1/20 0.51
GAA P10253 1/20 0.51
CNR1 P21554 1/20 0.50
ALDH1A1 P00352 1/20 0.50
HPGD P15428 1/20 0.50
TRPV1 Q8NER1 1/20 0.50

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
SCHEMBL74739 0.95 DNM1 (0.73) DNM1FAAHNAAACASP2EPHX2
SCHEMBL117354 0.95 DNM1 (0.73) DNM1FAAHNAAACASP2EPHX2
SCHEMBL8396456 0.95 DNM1 (0.73) DNM1FAAHNAAACASP2EPHX2
SCHEMBL76256 0.95 DNM1 (0.73) DNM1FAAHNAAACASP2EPHX2
SCHEMBL75692 0.95 DNM1 (0.73) DNM1FAAHNAAACASP2EPHX2
SCHEMBL8394943 0.95 DNM1 (0.73) DNM1FAAHNAAACASP2EPHX2
SCHEMBL785831 0.95 DNM1 (0.73) DNM1FAAHNAAACASP2EPHX2
SCHEMBL76220 0.95 DNM1 (0.73) DNM1FAAHNAAACASP2EPHX2
Sulfuric Acid SCHEMBL5013382 0.94 DNM1 (0.63) DNM1FAAHNAAACASP2EPHX2
SCHEMBL14569387 0.94 DNM1 (0.67) DNM1FAAHNAAACASP2EPHX2

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-0288515-B1 QUATERNIZED NITROGEN CONTAINING COMPOUNDS ISP INVESTMENTS INC. (US) 1993-05-05 EP disclosed
EP-0288515-A4 QUATERNIZED NITROGEN CONTAINING COMPOUNDS 1990-09-26 EP disclosed
US-4837013-A VISCOSITY ENHANCING AND HAIR CONDITIONING PROPERTIES GAF CORPORATION (US) 1989-06-06 US disclosed
EP-0288515-A1 QUATERNIZED NITROGEN CONTAINING COMPOUNDS. GAF CORP (US) 1988-11-02 EP disclosed
WO-1988002985-A1 QUATERNIZED NITROGEN CONTAINING COMPOUNDS GAF CORPORATION (US) 1988-05-05 WO disclosed