SCHEMBL3627637

SCHEMBL3627637

CCCCCCCCCC(CCCCCCCCS)C(S)CCCCCCCS

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 1/20 0.38
LMNA P02545 1/20 0.37
DNM1 Q05193 2/20 0.36
TSHR P16473 1/20 0.35
THRB P10828 1/20 0.35
OPRM1 P35372 1/20 0.34
GPR84 Q9NQS5 3/20 0.33
FDPS P14324 3/20 0.33
FFAR1 O14842 1/20 0.33
MAPT P10636 1/20 0.32
LCK P06239 1/20 0.32
PPARD Q03181 1/20 0.32
ZDHHC20 Q5W0Z9 1/20 0.32
ZDHHC2 Q9UIJ5 1/20 0.32
ADH1B P00325 1/20 0.31
ADH1C P00326 1/20 0.31
ADH1A P07327 1/20 0.31
ADH4 P08319 1/20 0.31
ADH7 P40394 1/20 0.31

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
SCHEMBL7075113 0.81 LMNA (0.35) SPHK1LMNADNM1TSHRTHRB
SCHEMBL29205016 0.79 LMNA (0.41) SPHK1LMNADNM1TSHRTHRB
SCHEMBL1261947 0.79 LMNA (0.41) SPHK1LMNADNM1TSHRTHRB
SCHEMBL10436559 0.79 LMNA (0.41) SPHK1LMNADNM1TSHRTHRB
SCHEMBL11357516 0.79 LMNA (0.41) SPHK1LMNADNM1TSHRTHRB
SCHEMBL5574289 0.79 LMNA (0.41) SPHK1LMNADNM1TSHRTHRB
SCHEMBL11827545 0.79 LMNA (0.41) SPHK1LMNADNM1TSHRTHRB
SCHEMBL3740402 0.79 LMNA (0.41) SPHK1LMNADNM1TSHRTHRB
SCHEMBL28612612 0.79 LMNA (0.41) SPHK1LMNADNM1TSHRTHRB
SCHEMBL11182983 0.79 LMNA (0.41) SPHK1LMNADNM1TSHRTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2147298-A1 DETECTION OF CANCER MARKERS Polytechnic University (US) 2010-01-27 EP disclosed
US-20090318788-A1 DETECTION OF CANCER MARKERS POLYTECHNIC UNIVERSITY 2009-12-24 US disclosed
WO-2008134511-A1 DETECTION OF CANCER MARKERS POLYTECHNIC UNIVERSITY (US) 2008-11-06 WO disclosed