SCHEMBL9127323

SCHEMBL9127323

CCCOC(C)Cc1ccc2cc(OC(C)=O)ccc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 2/20 0.44
▸ CA9 Q16790 2/20 0.44
▸ KDM4E B2RXH2 3/20 0.42
▸ POLB P06746 2/20 0.42
▸ GLA P06280 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ FLT3 P36888 1/20 0.41
▸ AKR1C3 P42330 2/20 0.40
▸ AKR1C2 P52895 2/20 0.40
▸ PTGS1 P23219 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ PTPN1 P18031 1/20 0.40
▸ NPC1 O15118 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ MAOA P21397 1/20 0.39

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
SCHEMBL9129827 0.84 ALOX15 (0.53) KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL8156103 0.84 HSD17B10 (0.49) POLBGAATDP1KMT2ALMNA
SCHEMBL9124146 0.83 CA12 (0.44) CA12CA9KDM4EPOLBGLA
SCHEMBL9128324 0.83 GRIN2D (0.43) AKR1C3AKR1C2KMT2AMAPTSMN1; SMN2
SCHEMBL9128075 0.81 GRIN2D (0.53) KDM4EAKR1C3AKR1C2KMT2ATP53
SCHEMBL9128788 0.80 KDM4E (0.48) CA12CA9KDM4EPOLBGLA
SCHEMBL9126828 0.79 CASR (0.39) AKR1C3AKR1C2PTPN1
Bromide SCHEMBL11271654 0.78 HTR2A (0.55) CA12CA9FLT3PTPN1SLC6A2
SCHEMBL15899528 0.77 LMNA (0.45) KMT2ALMNACYP1A2ACACB
SCHEMBL9128519 0.77 THRA (0.43) CA12CA9TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5422038-A Ferroelectric liquid crystal material with sufficient spontaneous polarization, high speed response capability, wide temperature range SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-06-06 — — US disclosed
EP-0416946-B1 Optically active naphthalene derivative, process for preparation thereof, liquid crystal composition containing the same as effective component, and liquid crystal element using the same SUMITOMO CHEMICAL CO (JP) 1994-11-09 — — EP disclosed
EP-0416946-A2 Optically active naphthalene derivative, process for preparation thereof, liquid crystal composition containing the same as effective component, and liquid crystal element using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-03-13 — — EP disclosed
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