SCHEMBL10382017

SCHEMBL10382017

[CH2]CCC(C=CC)CCCC

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
DNM1 Q05193 2/20 0.31

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
SCHEMBL3019715 0.92 LMNA (0.34) TSHRSMN1; SMN2DNM1
SCHEMBL3019713 0.92 LMNA (0.34) TSHRSMN1; SMN2DNM1
SCHEMBL12475219 0.89 TSHR (0.48) TSHRSMN1; SMN2DNM1
Ammonia Solution, Strong SCHEMBL28575731 0.86 TSHR (0.46) TSHRSMN1; SMN2DNM1
SCHEMBL12475735 0.84 TSHR (0.44) TSHRSMN1; SMN2DNM1
Hydrochloric Acid SCHEMBL28463630 0.84 TSHR (0.44) TSHRSMN1; SMN2DNM1
SCHEMBL5294434 0.83
SCHEMBL8755967 0.81 TSHR (0.41) TSHRSMN1; SMN2DNM1
SCHEMBL10467297 0.81 TSHR (0.41) TSHRSMN1; SMN2DNM1
SCHEMBL4797106 0.79 TSHR (0.56) TSHRSMN1; SMN2DNM1

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-0174956-B1 SOFT $g(b)-ADRENERGIC BLOCKING AGENTS BODOR, Nicholas S. (US) 1990-08-16 EP disclosed