SCHEMBL9416100

SCHEMBL9416100

CCCCCCCCCCC[CH]C(CCCC)CCCCCC

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.44
TSHR P16473 4/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
LMNA P02545 1/20 0.39
THRB P10828 1/20 0.38
FAAH O00519 2/20 0.38
TRPV1 Q8NER1 1/20 0.38
ADH1B P00325 1/20 0.38
ADH1C P00326 1/20 0.38
ADH1A P07327 1/20 0.38
ADH4 P08319 1/20 0.38
ADH7 P40394 1/20 0.38
CA2 P00918 1/20 0.38
OPRM1 P35372 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
SCHEMBL28950012 1.00 DNM1 (0.44) DNM1TSHRSMN1; SMN2LMNATHRB
SCHEMBL15544535 1.00 DNM1 (0.44) DNM1TSHRSMN1; SMN2LMNATHRB
SCHEMBL15902253 0.98 TSHR (0.44) DNM1TSHRSMN1; SMN2LMNATHRB
SCHEMBL29137408 0.98 TSHR (0.44) DNM1TSHRSMN1; SMN2LMNATHRB
SCHEMBL28100001 0.98 TSHR (0.44) DNM1TSHRSMN1; SMN2LMNATHRB
SCHEMBL6904564 0.98 DNM1 (0.46) DNM1TSHRSMN1; SMN2LMNATHRB
SCHEMBL15902252 0.98 TSHR (0.44) DNM1TSHRSMN1; SMN2LMNATHRB
SCHEMBL27300692 0.98 TSHR (0.44) DNM1TSHRSMN1; SMN2LMNATHRB
SCHEMBL21196910 0.98 TSHR (0.44) DNM1TSHRSMN1; SMN2LMNATHRB
SCHEMBL28099991 0.98 TSHR (0.44) DNM1TSHRSMN1; SMN2LMNATHRB

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
EP-0596304-A1 Cosmetic and pharmaceutical compositions Th. Goldschmidt AG (DE) 1994-05-11 EP disclosed