SCHEMBL19757434

SCHEMBL19757434

CCCCCCCCCCCCCCC(=O)c1ccc(Cc2ccccc2Cl)cc1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HSD17B3 P37058 6/20 0.54
▸ S1PR5 Q9H228 4/20 0.52
▸ S1PR2 O95136 1/20 0.48
▸ S1PR1 P21453 1/20 0.48
▸ S1PR3 Q99500 1/20 0.48
▸ LPAR2 Q9HBW0 1/20 0.48
▸ THRA P10827 5/20 0.48
▸ THRB P10828 5/20 0.48
▸ HTT P42858 1/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ LMNA P02545 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46

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
SCHEMBL19757449 0.83 HSD17B3 (0.63) HSD17B3S1PR5S1PR2S1PR1S1PR3
SCHEMBL19757432 0.81 HSD17B3 (0.61) HSD17B3S1PR5S1PR2S1PR1S1PR3
SCHEMBL19757425 0.81 HSD17B3 (0.56) HSD17B3S1PR5L3MBTL1LMNAMAPT
SCHEMBL9090207 0.79 HSD17B3 (0.48) HSD17B3S1PR2S1PR1S1PR3LPAR2
SCHEMBL19757458 0.77 HSD17B3 (0.59) HSD17B3S1PR5HTTL3MBTL1LMNA
SCHEMBL13085847 0.77 HSD17B3 (0.85) HSD17B3THRATHRBHTTL3MBTL1
SCHEMBL13085794 0.77 HSD17B3 (0.85) HSD17B3THRATHRBHTTL3MBTL1
SCHEMBL31186967 0.76 HSD17B3 (0.71) HSD17B3S1PR5THRATHRBL3MBTL1
SCHEMBL10832302 0.76 HSD17B3 (0.71) HSD17B3S1PR5THRATHRBL3MBTL1
SCHEMBL12303994 0.76 HSD17B3 (0.71) HSD17B3S1PR5S1PR2S1PR1S1PR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9855789-B2 Thermochromic color-memorizing composition and thermochromic color-memorizing microcapsule pigment encapsulating same THE PILOT INK CO., LTD. (JP) 2018-01-02 — — US disclosed
US-20170274698-A1 THERMOCHROMIC COLOR-MEMORIZING COMPOSITION AND THERMOCHROMIC COLOR-MEMORIZING MICROCAPSULE PIGMENT ENCAPSULATING SAME THE PILOT INK CO., LTD. (JP) 2017-09-28 — — US disclosed
Send feedback