SCHEMBL8599440

SCHEMBL8599440

CC/C=C/CC(c1ccccc1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
HTR2A P28223 7/20 0.41
HRH1 P35367 6/20 0.41
TAAR1 Q96RJ0 3/20 0.41
TDP1 Q9NUW8 1/20 0.40
POLB P06746 1/20 0.39
SIGMAR1 Q99720 1/20 0.38
MIF P14174 1/20 0.38
HKDC1 Q2TB90 1/20 0.37
TRPA1 O75762 1/20 0.37

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
SCHEMBL8599444 1.00 LMNA (0.46) LMNAHTR2AHRH1TAAR1TDP1
SCHEMBL10640638 0.85 LMNA (0.42) LMNAHTR2AHRH1TAAR1POLB
SCHEMBL10640640 0.85 LMNA (0.42) LMNAHTR2AHRH1TAAR1POLB
SCHEMBL10644867 0.83 TAAR1 (0.48) LMNAHTR2ATAAR1TRPA1
SCHEMBL10644871 0.83 TAAR1 (0.48) LMNAHTR2ATAAR1TRPA1
SCHEMBL28144387 0.81 LMNA (0.57) LMNATAAR1
SCHEMBL7404409 0.79 HTR2A (0.43) LMNAHTR2AHRH1TAAR1TDP1
SCHEMBL6910264 0.78 HTR2A (0.39) LMNAHTR2AHRH1TAAR1TDP1
SCHEMBL27759532 0.78 CHRNB2 (0.41) LMNAHTR2AHRH1TDP1
SCHEMBL16103786 0.78 LMNA (0.44) LMNAPOLBTRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0715613-B1 NEW DIPHENYLHEXENE PECHAN REINHARD (DE) 1998-01-28 EP disclosed
US-5650445-A Diphenylhexene composition for use in treating liver carcinoma and psoriasis PECHAN REINHARD (DE) 1997-07-22 US disclosed
US-5578742-A INHIBIT UNCONTROLLED CELL PROLIFERATION, TREATMENT OF PSORIASIS, AIDS, CANCER, ANTITUMOR METZLER MANFRED (DE) 1996-11-26 US disclosed
EP-0636115-B1 NOVEL BIS-PHENYL-HEXENES METZLER MANFRED (DE) 1996-08-14 EP disclosed
EP-0715613-A1 NEW DIPHENYLHEXENE PECHAN, Reinhard (DE) 1996-06-12 EP disclosed
WO-1995006020-A1 NEW DIPHENYLHEXENE PECHAN REINHARD (DE) 1995-03-02 WO disclosed
EP-0636115-A1 NOVEL BIS-PHENYL-HEXENES. METZLER MANFRED (DE) 1995-02-01 EP disclosed
WO-1993022262-A1 NOVEL BIS-PHENYL-HEXENES METZLER MANFRED (DE) 1993-11-11 WO disclosed