SCHEMBL28006983

SCHEMBL28006983

CCCC(O)CCc1ccc(O)cc1.Cc1ccc(C(=O)O)cc1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 1/20 0.45
▸ RARB P10826 4/20 0.41
▸ PTGER4 P35408 2/20 0.40
▸ PTGER2 P43116 2/20 0.40
▸ TRPV1 Q8NER1 1/20 0.40
▸ MMP12 P39900 1/20 0.39
▸ MMP13 P45452 1/20 0.39
▸ PRKCG P05129 1/20 0.38
▸ PRKCB P05771 1/20 0.38
▸ PRKCA P17252 1/20 0.38
▸ PRKCH P24723 1/20 0.38
▸ PRKCE Q02156 1/20 0.38
▸ PRKCD Q05655 1/20 0.38
▸ PLK1 P53350 4/20 0.38
▸ MCL1 Q07820 1/20 0.38
▸ ESR1 P03372 1/20 0.38
▸ ESR2 Q92731 1/20 0.38
▸ PLK3 Q9H4B4 1/20 0.38

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
SCHEMBL28006630 0.90 POLB (0.44) DPP4RARBPTGER4PTGER2MMP12
SCHEMBL28006638 0.83 MEN1 (0.40) RARBESR1ESR2
SCHEMBL28006986 0.83 RARB (0.60) RARBPLK1ESR1PLK3
SCHEMBL28006626 0.83 DPP4 (0.46) DPP4RARBPTGER4PTGER2TRPV1
SCHEMBL28006960 0.82 TRPV1 (0.42) RARBPTGER4PTGER2TRPV1PLK1
SCHEMBL28954234 0.81 RARB (0.62) RARBPLK1ESR1PLK3
SCHEMBL28006657 0.81 SELL (0.41) RARBTRPV1PRKCGPRKCBPRKCA
SCHEMBL28006950 0.81 IAPP (0.48) RARBTRPV1PLK1MCL1ESR1
SCHEMBL28007037 0.79 IAPP (0.47) RARBTRPV1
SCHEMBL28006955 0.78 MEN1 (0.42) ESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107208120-A Rapid pretreatment 斯威特沃特能源公司 2017-09-26 — — CN disclosed
CN-104428421-A Process for using tobacco KIND CONSUMER LTD 2015-03-18 — — CN disclosed
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