SCHEMBL31313383

SCHEMBL31313383

CC(C)CCCCCc1cc(C(=O)O)ccn1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRIN2D O15399 1/20 0.48
▸ GRIN2A Q12879 1/20 0.48
▸ GRIN2B Q13224 1/20 0.48
▸ GRIN2C Q14957 1/20 0.48
▸ RARB P10826 1/20 0.48
▸ CYP4F2 P78329 1/20 0.45
▸ CYP4A11 Q02928 1/20 0.45
▸ KDM5B Q9UGL1 7/20 0.44
▸ KDM4C Q9H3R0 5/20 0.44
▸ KDM5A P29375 5/20 0.44
▸ KDM5C P41229 6/20 0.43
▸ KDM4E B2RXH2 4/20 0.42
▸ KDM6B O15054 4/20 0.42
▸ KDM4A O75164 4/20 0.42
▸ KDM2A Q9Y2K7 3/20 0.42
▸ KDM3A Q9Y4C1 3/20 0.42
▸ KDM4D Q6B0I6 2/20 0.42
▸ TET3 O43151 1/20 0.42
▸ BBOX1 O75936 1/20 0.42
▸ ALDH1A1 P00352 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
SCHEMBL16055909 0.88 MAPK1 (0.47) GRIN2DGRIN2AGRIN2BGRIN2CRARB
SCHEMBL3122441 0.84 KDM5A (0.56) RARBKDM5BKDM4CKDM5AKDM4E
SCHEMBL29184940 0.84 KDM5A (0.56) RARBKDM5BKDM4CKDM5AKDM4E
SCHEMBL31313484 0.84 KDM5A (0.56) RARBKDM5BKDM4CKDM5AKDM4E
SCHEMBL31313418 0.84 KDM5A (0.56) RARBKDM5BKDM4CKDM5AKDM4E
Hydrochloric Acid SCHEMBL28563711 0.82 KDM5A (0.55) RARBKDM5BKDM4CKDM5AKDM4E
SCHEMBL28092824 0.82 KDM5A (0.58) RARBCYP4F2CYP4A11KDM5BKDM4C
SCHEMBL16055788 0.80 KDM5B (0.63) RARBCYP4F2CYP4A11KDM5BKDM4C
SCHEMBL1425290 0.79 KDM5B (0.50) KDM5BKDM4CKDM5AKDM5CKDM4E
SCHEMBL16055756 0.77 KDM4E (0.65) CYP4F2CYP4A11KDM5BKDM4CKDM5A

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
CN-119433225-A Extractant for separating and recycling metal elements in battery feed liquid, extraction method and application thereof 中国科学院长春应用化学研究所 2025-02-14 — — CN disclosed
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