SCHEMBL10338681

SCHEMBL10338681

CCCCCCCCCCCCCCCO.c1ccc2ooc2c1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.54
▸ ALDH1A1 P00352 3/20 0.54
▸ TSHR P16473 2/20 0.54
▸ HSD17B10 Q99714 1/20 0.54
▸ MEN1 O00255 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ FAAH O00519 2/20 0.40
▸ LIPG Q9Y5X9 1/20 0.40
▸ MGLL Q99685 1/20 0.40
▸ CES2 O00748 1/20 0.38
▸ CES1 P23141 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
Decanol SCHEMBL27731676 0.80 LMNA (0.62) LMNAALDH1A1TSHRHSD17B10MEN1
Naphthalene SCHEMBL15537489 0.80 LMNA (0.62) LMNAALDH1A1TSHRHSD17B10MEN1
Nonanol SCHEMBL29217536 0.80 LMNA (0.62) LMNAALDH1A1TSHRHSD17B10MEN1
Biphenyl SCHEMBL27430214 0.78 LMNA (0.59) LMNAALDH1A1TSHRHSD17B10MEN1
Biphenyl SCHEMBL29066821 0.78 LMNA (0.59) LMNAALDH1A1TSHRHSD17B10MEN1
Catechol SCHEMBL28180547 0.78 ALDH1A1 (0.59) LMNAALDH1A1TSHRHSD17B10MEN1
Dodecanol SCHEMBL27960968 0.78 LMNA (0.59) LMNAALDH1A1TSHRHSD17B10MEN1
Octanol SCHEMBL3281086 0.78 ALDH1A1 (0.59) LMNAALDH1A1TSHRHSD17B10MEN1
O-Xylene SCHEMBL11395219 0.78 ALDH1A1 (0.59) LMNAALDH1A1TSHRHSD17B10MEN1
1-Hexanol SCHEMBL9342119 0.77 LMNA (0.56) LMNAALDH1A1TSHRHSD17B10MEN1

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
JP-2101036-A — — None — — JP disclosed
JP-H02101036-A ALKYLBENZENE DERIVATIVE AND MEDICINE THEREFROM YAMANOUCHI PHARMACEUT CO LTD 1990-04-12 — — JP disclosed
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