SCHEMBL27980992

SCHEMBL27980992

CCCc1c(C)cccc1Oc1ccccc1O

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ GAA P10253 2/20 0.39
▸ JAK2 O60674 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ LTB4R Q15722 3/20 0.39
▸ LTB4R2 Q9NPC1 3/20 0.39
▸ TRPA1 O75762 2/20 0.38
▸ ATM Q13315 1/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ ESR1 P03372 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ ESR2 Q92731 1/20 0.37

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
SCHEMBL27980753 0.90 ALOX5 (0.45) —
SCHEMBL982656 0.83 LTB4R (0.44) LMNAALOX15CA1CA2TP53
SCHEMBL27980706 0.81 LTB4R (0.34) LMNAALOX15TSHRLTB4RLTB4R2
SCHEMBL354051 0.80 TRPA1 (0.48) CA1CA2TP53TSHRGAA
SCHEMBL31457122 0.79 TSHR (0.38) TSHRGAAMAPT
SCHEMBL1838446 0.79 CA1 (0.40) LMNAALOX15CA1CA2TP53
SCHEMBL28785460 0.78 ALOX5 (0.40) LMNATSHRMAPTMEN1KMT2A
SCHEMBL27980967 0.78 LMNA (0.43) LMNAALOX15CA1CA2TP53
SCHEMBL981248 0.78 TSHR (0.54) LMNAALOX15CA1CA2TP53
SCHEMBL980194 0.78 ALOX5 (0.49) LMNAALOX15LTB4RLTB4R2

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-102471244-B Process for producing N-substituted carbamate, process for producing isocyanate using the N-substituted carbamate, and composition for transporting and storing N-substituted carbamate containing N-substituted carbamate and aromatic hydroxy compound ASAHI CHEMICAL CORP 2014-09-24 — — CN disclosed
Send feedback