SCHEMBL9341961

SCHEMBL9341961

CCCCCCc1ccccc1C=CC(=S)c1ccc(CC)cc1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SLC16A3 O15427 1/20 0.41
▸ LIPG Q9Y5X9 1/20 0.41
▸ THRA P10827 3/20 0.39
▸ THRB P10828 3/20 0.39
▸ ATG4B Q9Y4P1 11/20 0.39
▸ PLA2G1B P04054 9/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ RECQL P46063 1/20 0.39

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
SCHEMBL9338260 0.99 SLC16A3 (0.40) SLC16A3LIPGTHRATHRBATG4B
SCHEMBL9337936 0.95 SLC16A3 (0.38) SLC16A3LIPGTHRATHRB
SCHEMBL10497563 0.93 THRA (0.45) LIPGTHRATHRBATG4BPLA2G1B
SCHEMBL10497772 0.90 THRA (0.45) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL9341673 0.90 SMN1; SMN2 (0.39) SLC16A3THRB
SCHEMBL9338280 0.85 SMN1; SMN2 (0.42) SLC16A3TDP1
SCHEMBL10497881 0.81 THRA (0.47) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL10497660 0.81 THRA (0.46) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL10497685 0.80 THRA (0.45) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL9338240 0.79 THRA (0.49) THRATHRBATG4BPLA2G1BCYP1A2

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-0328668-B1 NONLINEAR OPTICAL MATERIAL NIPPON OILS & FATS CO LTD (JP) 1994-05-25 — — EP disclosed
US-5045239-A Chalcone derivative NIPPON OIL AND FATS CO., LTD. (JP) 1991-09-03 — — US disclosed
EP-0328668-A1 NONLINEAR OPTICAL MATERIAL NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-08-23 — — EP disclosed
EP-0328669-A1 CHALCONE DERIVATIVE COMPOUNDS NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-08-23 — — EP disclosed
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