SCHEMBL4739279

SCHEMBL4739279

C=CCCCCC(=CCCC)CCCC=CC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.41
ALDH1A1 P00352 2/20 0.39
MAPT P10636 3/20 0.36
ABCC4 O15439 1/20 0.36
LMNA P02545 2/20 0.36
TERT O14746 3/20 0.33
CYP1A2 P05177 2/20 0.33
CYP2C19 P33261 2/20 0.33
BLM P54132 2/20 0.33
HSD17B10 Q99714 2/20 0.33
FABP4 P15090 2/20 0.33
F7 P08709 2/20 0.33
F3 P13726 2/20 0.33
FAAH O00519 2/20 0.33
PTPN1 P18031 2/20 0.33
PPARG P37231 2/20 0.33
KMT2A Q03164 2/20 0.33
PPARD Q03181 2/20 0.33
PPARA Q07869 2/20 0.33
GMNN O75496 1/20 0.33

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
SCHEMBL3242777 0.89 MAPT (0.42) TSHRALDH1A1MAPTABCC4LMNA
SCHEMBL4428119 0.84 TSHR (0.38) TSHRALDH1A1MAPTABCC4LMNA
SCHEMBL8746616 0.81 TSHR (0.57) TSHRMAPTLMNATERTCYP1A2
SCHEMBL10812097 0.81 TSHR (0.57) TSHRMAPTLMNATERTCYP1A2
SCHEMBL846882 0.80 TSHR (0.46) TSHRALDH1A1MAPTABCC4LMNA
SCHEMBL846883 0.80 TSHR (0.46) TSHRALDH1A1MAPTABCC4LMNA
SCHEMBL8591345 0.79 TSHR (0.38) TSHRMAPTABCC4LMNATERT
SCHEMBL11499534 0.78 TSHR (0.37) TSHRALDH1A1PPARGPTGS1
SCHEMBL3737327 0.78 TSHR (0.64) TSHRALDH1A1MAPTABCC4LMNA
SCHEMBL7625618 0.78 TSHR (0.64) TSHRALDH1A1MAPTABCC4LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008064957-A1 PROCESS FOR PREPARING POLYBUTENE COMPOSITIONS HAVING INCREASED CRYSTALLIZATION TEMPERATURE BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2008-06-05 WO disclosed