SCHEMBL22920719

SCHEMBL22920719

CCC(C)(C)Nc1ccc(Oc2ccc(NC(=O)c3ccc(C(=O)C(C)(C)CC)cc3)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 2/20 0.48
▸ NPC1 O15118 6/20 0.47
▸ RAB9A P51151 6/20 0.47
▸ SMN1; SMN2 Q16637 4/20 0.47
▸ TP53 P04637 2/20 0.47
▸ ALOX15 P16050 1/20 0.47
▸ KDM4E B2RXH2 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ MAPT P10636 3/20 0.45
▸ TRPV1 Q8NER1 2/20 0.44
▸ HDAC1 Q13547 1/20 0.44
▸ DUSP3 P51452 1/20 0.43
▸ PTPN5 P54829 1/20 0.43
▸ PTPN11 Q06124 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ MCHR1 Q99705 1/20 0.42

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
SCHEMBL13213695 0.92 HDAC3 (0.47) NPC1RAB9ASMN1; SMN2TP53ALOX15
SCHEMBL16504163 0.88 HDAC3 (0.46) NPC1RAB9ASMN1; SMN2MAPTTRPV1
SCHEMBL13283413 0.86 HDAC1 (0.42) ALDH1A1MAPTHDAC1
SCHEMBL13866520 0.84 NAMPT (0.37) RAB9ATP53KDM4EALDH1A1HDAC1
SCHEMBL24169215 0.82 HDAC3 (0.48) NPC1RAB9ASMN1; SMN2TP53ALOX15
SCHEMBL13891363 0.81 MAPK1 (0.45) PGRNPC1RAB9AALDH1A1MAPT
SCHEMBL14153945 0.80 TDP1 (0.50) PGRALDH1A1HDAC1DUSP3PTPN5
SCHEMBL10028740 0.80 HPGD (0.50) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL12355630 0.79 HDAC2 (0.57) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL12128359 0.77 NQO2 (0.44) NPC1RAB9ASMN1; SMN2TP53MAPT

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
US-20210028399-A1 DISPLAY DEVICE SHARP KABUSHIKI KAISHA (JP) 2021-01-28 — — US disclosed
Send feedback