SCHEMBL27892575

SCHEMBL27892575

CCCCc1ccc(-c2c(C(=O)O)cccc2C(=O)OC)cc1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 9/20 0.51
▸ DHODH Q02127 1/20 0.47
▸ PLK1 P53350 5/20 0.47
▸ AKR1C2 P52895 1/20 0.47
▸ AKR1C1 Q04828 1/20 0.47
▸ RARA P10276 2/20 0.46
▸ RARG P13631 1/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ MTOR P42345 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ PLK3 Q9H4B4 3/20 0.45
▸ LTB4R2 Q9NPC1 1/20 0.45

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
SCHEMBL27892517 0.88 SMN1; SMN2 (0.44) MEN1ALDH1A1MAPTKMT2ALTB4R2
SCHEMBL27892535 0.87 MAPK8 (0.47) DHODHPLK1AKR1C2AKR1C1
SCHEMBL27875977 0.83 LOXL2 (0.53) MEN1ALDH1A1MAPTKMT2A
SCHEMBL20497181 0.83 THRB (0.53) RARBPLK1RARARARGMEN1
Butylbenzyl SCHEMBL27284116 0.82 KDM4E (0.52) RARBPLK1ALDH1A1PLK3
SCHEMBL7729718 0.81 MCL1 (0.58) RARBDHODHPLK1AKR1C2AKR1C1
SCHEMBL29094948 0.80 FABP4 (0.54) MEN1ALDH1A1MAPTKMT2A
SCHEMBL11521526 0.79 RARB (0.57) RARBPLK1RARARARGMEN1
SCHEMBL27892555 0.78 SMN1; SMN2 (0.45) MEN1ALDH1A1MAPTKMT2ALTB4R2
SCHEMBL27454418 0.77 ALDH1A1 (0.49) MEN1ALDH1A1MAPTKMT2A

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-102731722-B For the production of the method for modified conjugated diene polymer, modified conjugated diene polymer and polymer composition SUMITOMO CHEMICAL CO., LTD. (JP) 2016-03-16 — — CN disclosed
CN-102731722-A Process for producing modified conjugated diene-based polymer, modified conjugated diene-based polymer, and polymer composition SUMITOMO CHEMICAL CO 2012-10-17 — — CN disclosed
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