SCHEMBL7790055

SCHEMBL7790055

CCCCCCCCCCCCCCOCCC(N)CCOCCCCCCCCCCCCCC

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.50
MEN1 O00255 1/20 0.50
THRB P10828 1/20 0.50
KMT2A Q03164 1/20 0.50
MAPT P10636 1/20 0.50
USP2 O75604 1/20 0.44
CES2 O00748 1/20 0.42
DNM1 Q05193 1/20 0.42
S1PR2 O95136 5/20 0.41
S1PR1 P21453 5/20 0.41
S1PR3 Q99500 5/20 0.41
S1PR4 O95977 4/20 0.41
OPRM1 P35372 1/20 0.41
PLA2G1B P04054 1/20 0.41
PLA2G2A P14555 1/20 0.41
PLA2G2C Q5R387 1/20 0.40
ALDH1A1 P00352 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
TSHR P16473 1/20 0.39

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
SCHEMBL775435 0.96 S1PR2 (0.47) HTTMEN1THRBKMT2AMAPT
SCHEMBL3451340 0.96 S1PR2 (0.47) HTTMEN1THRBKMT2AMAPT
SCHEMBL6262669 0.96 S1PR2 (0.47) HTTMEN1THRBKMT2AMAPT
SCHEMBL6259967 0.96 S1PR2 (0.47) HTTMEN1THRBKMT2AMAPT
SCHEMBL9807769 0.92 HTT (0.46) HTTMEN1THRBKMT2AMAPT
SCHEMBL17883707 0.92 HTT (0.46) HTTMEN1THRBKMT2AMAPT
SCHEMBL9464121 0.91 HTT (0.47) HTTMEN1THRBKMT2AMAPT
SCHEMBL10168299 0.91 HTT (0.47) HTTMEN1THRBKMT2AMAPT
SCHEMBL11231054 0.91 S1PR2 (0.50) HTTMEN1THRBKMT2AMAPT
SCHEMBL11230762 0.91 S1PR2 (0.50) HTTMEN1THRBKMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0902780-B1 QUATERNARY CYTOFECTINS VICAL INC (US) 2001-10-31 EP disclosed
US-5994317-A DRUG DELIVERY; INSERTION MATERIAL INTO CELL VICAL INCORPORATED (US) 1999-11-30 US disclosed