SCHEMBL21183193

SCHEMBL21183193

Cc1ccccc1C(=O)c1ccc2c(c1)CC1=CCCC=C12

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.45
▸ HTT P42858 1/20 0.45
▸ MAPK13 O15264 5/20 0.40
▸ MAPK12 P53778 5/20 0.40
▸ MAPK11 Q15759 5/20 0.40
▸ MAPK14 Q16539 5/20 0.40
▸ NPC1 O15118 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ CTNNB1 P35222 3/20 0.37
▸ WNT3A P56704 3/20 0.37
▸ SRD5A2 P31213 1/20 0.37
▸ CYP2C8 P10632 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ FFAR1 O14842 1/20 0.34
▸ CDC25A P30304 1/20 0.33
▸ CDC25B P30305 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ HSD17B1 P14061 1/20 0.33

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
SCHEMBL21025037 0.79 SRD5A2 (0.60) ALDH1A1HTTMAPK13MAPK12MAPK11
SCHEMBL21183194 0.75 RAB9A (0.46) ALDH1A1HTTMAPK13MAPK12MAPK11
SCHEMBL7930941 0.73 MAPT (0.53) ALDH1A1HTTMAPK13MAPK12MAPK11
SCHEMBL21025427 0.71 RAB9A (0.41) ALDH1A1HTTMAPK13MAPK12MAPK11
SCHEMBL132972 0.70 ALDH1A1 (0.48) ALDH1A1HTTMAPK13MAPK12MAPK11
SCHEMBL28878766 0.70 NPC1 (0.40) ALDH1A1HTTMAPK13MAPK12MAPK11
SCHEMBL11363921 0.69 ALDH1A1 (0.46) ALDH1A1HTTMAPK13MAPK12MAPK11
SCHEMBL12792043 0.68 ALDH1A1 (0.74) ALDH1A1HTTMAPK13MAPK12MAPK11
SCHEMBL8549974 0.68 POLB (0.58) ALDH1A1HTTMAPK13MAPK12MAPK11
SCHEMBL21025031 0.67 ALDH1A1 (0.47) ALDH1A1HTTMAPK13MAPK12MAPK11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3514135-A1 FLUORENE PHOTOINITIATOR, PREPARATION METHOD THEREFOR, PHOTOCURABLE COMPOSITION HAVING SAME, AND USE OF SAME IN PHOTOCURING FIELD Changzhou Tronly Advanced Electronic Materials Co., Ltd. (CN) 2019-07-24 — — EP disclosed
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