SCHEMBL9306660

SCHEMBL9306660

CCCOc1ccc(C(=O)CC(=O)C(C)(C)C)cc1OC

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.55
▸ HSD17B10 Q99714 1/20 0.55
▸ THRA P10827 1/20 0.52
▸ THRB P10828 1/20 0.52
▸ MEN1 O00255 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ PDE4B Q07343 1/20 0.51
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ KDM4E B2RXH2 2/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ MAPT P10636 1/20 0.49
▸ CYP2C9 P11712 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ PDE4D Q08499 1/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ SMPD1 P17405 3/20 0.47

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
SCHEMBL13773006 0.94 THRA (0.57) HPGDHSD17B10THRATHRBMEN1
SCHEMBL13773009 0.91 THRA (0.64) THRATHRBPDE4BTSHRSMPD1
SCHEMBL13773010 0.88 SMPD1 (0.58) THRATHRBPDE4BPDE4DSMPD1
SCHEMBL480333 0.87 MAPT (0.57) MEN1KMT2APDE4BSMN1; SMN2CYP1A2
SCHEMBL13773013 0.84 THRA (0.45) HPGDTHRATHRBMEN1KMT2A
SCHEMBL4141881 0.84 KDM4E (0.53) THRATHRBMEN1KMT2AKDM4E
SCHEMBL13773008 0.83 MEN1 (0.47) HPGDMEN1KMT2APDE4BSMN1; SMN2
SCHEMBL13773002 0.82 THRA (0.43) HPGDTHRATHRBMEN1KMT2A
SCHEMBL4144753 0.82 KMT2A (0.52) HPGDMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL4145207 0.82 KDM4E (0.70) HPGDMEN1KMT2APDE4BSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5371296-A Light stability, sunburn prevention KAO CORPORATION (JP) 1994-12-06 — — US claimed
EP-0504844-A2 4,4-Dimethyl-1-phenylpentane-1,3-dione derivative and UV ray absorbent and cosmetic containing the same KAO CORPORATION (JP) 1992-09-23 — — EP claimed
US-5371296-A Light stability, sunburn prevention KAO CORPORATION (JP) 1994-12-06 — — US disclosed
US-5191121-A Sunscreen KAO CORPORATION (JP) 1993-03-02 — — US disclosed
EP-0504844-A2 4,4-Dimethyl-1-phenylpentane-1,3-dione derivative and UV ray absorbent and cosmetic containing the same KAO CORPORATION (JP) 1992-09-23 — — EP disclosed
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