SCHEMBL8373134

SCHEMBL8373134

CCC(Cl)CC([O])C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPK1 P28482 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL8371146 0.72 TSHR (0.32) TSHR
SCHEMBL277039 0.72
SCHEMBL21021642 0.71
SCHEMBL8375225 0.70
SCHEMBL8375215 0.70 TSHR (0.31) TSHR
SCHEMBL17195475 0.68 ALDH1A1 (0.50) TSHRALDH1A1MAPK1TDP1
SCHEMBL18899583 0.65 ALDH1A1 (0.54) TSHRALDH1A1MAPK1TDP1
SCHEMBL21021716 0.65
SCHEMBL11714498 0.65
SCHEMBL83191 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0619345-B1 Phthalocyanine compound and optical recording medium containing it MITSUI CHEMICALS INC (JP) 1999-08-25 EP disclosed
US-5750229-A Phthalocyanine compound and optical recording medium containing it MITSUI TOATSU CHEMICALS, INC. (JP) 1998-05-12 US disclosed
US-5646273-A FOR USE IN OPTICAL DISKS MITSUI TOATSU CHEMICALS, INC. (JP) 1997-07-08 US disclosed
EP-0619345-A1 Phthalocyanine compound and optical recording medium containing it MITSUI TOATSU CHEMICALS, Inc. (JP) 1994-10-12 EP disclosed