SCHEMBL7872835

SCHEMBL7872835

[CH2]CC(I)CCCCCC

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
DNM1 Q05193 2/20 0.40
TSHR P16473 1/20 0.40
THRB P10828 1/20 0.40
OPRM1 P35372 1/20 0.39
GPR84 Q9NQS5 3/20 0.37
FDPS P14324 3/20 0.37
SPHK1 Q9NYA1 1/20 0.37
FFAR1 O14842 1/20 0.37
MAPT P10636 1/20 0.35
LCK P06239 1/20 0.35
PPARD Q03181 1/20 0.35
ZDHHC20 Q5W0Z9 1/20 0.35
ZDHHC2 Q9UIJ5 1/20 0.35

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
SCHEMBL28797201 1.00 LMNA (0.41) LMNADNM1TSHRTHRBOPRM1
SCHEMBL7863889 1.00 LMNA (0.41) LMNADNM1TSHRTHRBOPRM1
SCHEMBL7871041 0.97
SCHEMBL7870984 0.90
SCHEMBL18324135 0.84 TSHR (0.50) LMNADNM1TSHRTHRBOPRM1
SCHEMBL2507860 0.84 TSHR (0.50) LMNADNM1TSHRTHRBOPRM1
SCHEMBL1333027 0.84 TSHR (0.50) LMNADNM1TSHRTHRBOPRM1
SCHEMBL1001552 0.84 TSHR (0.50) LMNADNM1TSHRTHRBOPRM1
SCHEMBL21436918 0.84 TSHR (0.50) LMNADNM1TSHRTHRBOPRM1
SCHEMBL17879364 0.84 TSHR (0.50) LMNADNM1TSHRTHRBOPRM1

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-0719839-B1 Phthalocyanine compounds and optical recording media comprising them MITSUI CHEMICALS INC (JP) 2001-07-25 EP disclosed
US-5693396-A NEAR INFRARED LIGHT ABSORBERS MITSUI TOATSU CHEMICALS, INC. (JP) 1997-12-02 US disclosed
EP-0719839-A2 Phthalocyanine compounds and optical recording media comprising them MITSUI TOATSU CHEMICALS, Inc. (JP) 1996-07-03 EP disclosed