SCHEMBL17737141

SCHEMBL17737141

CCCCCCCCCCCCOC(=O)c1ccc(-c2ccccc2)c(C)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 1/20 0.60
▸ ESR1 P03372 4/20 0.59
▸ RARB P10826 1/20 0.58
▸ ALDH1A1 P00352 3/20 0.54
▸ TSHR P16473 2/20 0.54
▸ LMNA P02545 2/20 0.54
▸ NPC1 O15118 1/20 0.53
▸ MAPT P10636 1/20 0.53
▸ RAB9A P51151 1/20 0.53
▸ TP53 P04637 1/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ AKR1C4 P17516 1/20 0.50
▸ AKR1C3 P42330 1/20 0.50
▸ AKR1C2 P52895 1/20 0.50
▸ AKR1C1 Q04828 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.48
▸ POLB P06746 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.48

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
SCHEMBL30752399 0.86 PTPN11 (0.61) CNR2ESR1ALDH1A1TSHRLMNA
SCHEMBL3586442 0.85 RAB9A (0.53) ALDH1A1LMNANPC1MAPTRAB9A
SCHEMBL15901617 0.84 ALDH1A1 (0.59) CNR2ESR1ALDH1A1TSHRLMNA
SCHEMBL17737145 0.84 ALDH1A1 (0.59) CNR2ESR1ALDH1A1TSHRLMNA
SCHEMBL15907996 0.84 CNR2 (0.55) CNR2ESR1ALDH1A1TSHRLMNA
Biphenyl SCHEMBL10951718 0.84 TSHR (0.59) CNR2ESR1ALDH1A1TSHRLMNA
Biphenyl SCHEMBL10950374 0.84 TSHR (0.59) CNR2ESR1ALDH1A1TSHRLMNA
SCHEMBL17737143 0.82 ALDH1A1 (0.68) CNR2ESR1RARBALDH1A1TSHR
SCHEMBL17737169 0.82 ALDH1A1 (0.68) CNR2ESR1RARBALDH1A1TSHR
SCHEMBL17737138 0.82 ALDH1A1 (0.68) CNR2ESR1RARBALDH1A1TSHR

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
US-9695329-B2 Thermochromic color-memory composition and thermochromic color-memory microcapsule pigment encapsulating same THE PILOT INK CO., LTD. (JP) 2017-07-04 — — US disclosed
US-9695329-B2 Thermochromic color-memory composition and thermochromic color-memory microcapsule pigment encapsulating same THE PILOT INK CO., LTD. (JP) 2017-07-04 — — US disclosed
US-20160130455-A1 THERMOCHROMIC COLOR-MEMORY COMPOSITION AND THERMOCHROMIC COLOR-MEMORY MICROCAPSULE PIGMENT ENCAPSULATING SAME THE PILOT INK CO., LTD. (JP) 2016-05-12 — — US disclosed
US-20160130455-A1 THERMOCHROMIC COLOR-MEMORY COMPOSITION AND THERMOCHROMIC COLOR-MEMORY MICROCAPSULE PIGMENT ENCAPSULATING SAME THE PILOT INK CO., LTD. (JP) 2016-05-12 — — US disclosed
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