SCHEMBL10770337

SCHEMBL10770337

[CH2]c1ccc(OCC(O)CN)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ TSHR P16473 3/20 0.45
▸ MAPT P10636 3/20 0.44
▸ LMNA P02545 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ ALOX15 P16050 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ GLA P06280 1/20 0.44
▸ USP2 O75604 1/20 0.44
▸ NR2E1 Q9Y466 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.43
▸ CYP1A2 P05177 1/20 0.42
▸ ATM Q13315 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ CA4 P22748 1/20 0.41
▸ CA7 P43166 1/20 0.41

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
SCHEMBL11127254 0.90 SMN1; SMN2 (0.61) SMN1; SMN2KMT2ATSHRMAPTLMNA
SCHEMBL6746278 0.84 AR (0.54) SMN1; SMN2KMT2ATSHRMAPTLMNA
SCHEMBL6074194 0.82 PTGS1 (0.57) SMN1; SMN2KMT2ATSHRMAPTLMNA
SCHEMBL6074318 0.82 PTGS1 (0.57) SMN1; SMN2KMT2ATSHRMAPTLMNA
SCHEMBL3730012 0.81 MAPT (0.44) SMN1; SMN2TSHRMAPTLMNAPOLB
SCHEMBL16314627 0.81 SMN1; SMN2 (0.53) SMN1; SMN2KMT2ATSHRMAPTLMNA
SCHEMBL8799683 0.81 CYP1A2 (0.63) SMN1; SMN2KMT2ATSHRMAPTALDH1A1
SCHEMBL768290 0.81 KMT2A (0.53) SMN1; SMN2KMT2ATSHRMAPTALOX15
SCHEMBL768526 0.81 KMT2A (0.53) SMN1; SMN2KMT2ATSHRMAPTALOX15
SCHEMBL6262230 0.81 MAPT (0.57) SMN1; SMN2KMT2ATSHRMAPTLMNA

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-0228192-A2 Renin-inhibitory oligopeptides, their preparation and use SANKYO COMPANY LIMITED (JP) 1987-07-08 — — EP disclosed
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