SCHEMBL7778401

SCHEMBL7778401

CCCCCCCCCCCCCC1=NC(CCN)CN1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.36
DNM1 Q05193 8/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
EPHX1 P07099 1/20 0.33
NOS1 P29475 2/20 0.33
NOS2 P35228 2/20 0.33
NOS3 P29474 1/20 0.32

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
SCHEMBL11640985 1.00 HTR2A (0.36) HTR2ADNM1MEN1KMT2AALDH1A1
SCHEMBL10883098 1.00 HTR2A (0.36) HTR2ADNM1MEN1KMT2AALDH1A1
SCHEMBL8404962 1.00 HTR2A (0.36) HTR2ADNM1MEN1KMT2AALDH1A1
SCHEMBL3450323 0.93 EPHX2 (0.36) MEN1KMT2A
SCHEMBL20954129 0.88 SCN2A (0.36) ALDH1A1NOS1NOS2NOS3
SCHEMBL4665788 0.88 SCN2A (0.36) ALDH1A1NOS1NOS2NOS3
SCHEMBL11138004 0.88 SCN2A (0.36) ALDH1A1NOS1NOS2NOS3
SCHEMBL20954138 0.88 SCN2A (0.36) ALDH1A1NOS1NOS2NOS3
SCHEMBL7698170 0.86 NOS1 (0.36) NOS1NOS2NOS3
SCHEMBL1648426 0.84 GBA1 (0.35) MEN1KMT2AALDH1A1TSHR

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
WO-2000031191-A9 POWDER-COATING COMPOSITIONS CONTAINING TRANSFER EFFICIENCY-ENHANCING ADDITIVES LUBRIZOL CORP (US) 2001-10-11 WO disclosed
EP-1133535-A1 POWDER-COATING COMPOSITIONS CONTAINING TRANSFER EFFICIENCY-ENHANCING ADDITIVES The Lubrizol Corporation (US) 2001-09-19 EP disclosed
WO-2000031191-A1 POWDER-COATING COMPOSITIONS CONTAINING TRANSFER EFFICIENCY-ENHANCING ADDITIVES THE LUBRIZOL CORPORATION (US) 2000-06-02 WO disclosed
EP-0391993-A1 LUBRICANT COMPOSITIONS AND ADDITIVE CONCENTRATES FOR THEIR PREPARATION. LUBRIZOL GENETICS INC (US) 1990-10-17 EP disclosed
WO-1990004626-A2 LUBRICANT AND FUNCTIONAL FLUID COMPOSITIONS EXHIBITING IMPROVED DEMULSIBILITY THE LUBRIZOL CORPORATION (US) 1990-05-03 WO disclosed