SCHEMBL10360437

SCHEMBL10360437

CC(Oc1ncn(-c2cccc(Br)c2)n1)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 2/20 0.40
RPA1 P27694 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.37
HSD17B10 Q99714 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ATM Q13315 1/20 0.36
PDE4A P27815 1/20 0.36
KCNH2 Q12809 1/20 0.36
RXRA P19793 1/20 0.36
GRIN1 Q05586 1/20 0.36
GRIN2B Q13224 1/20 0.36
HTT P42858 1/20 0.36
MITF O75030 1/20 0.35

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
SCHEMBL10360365 0.89 MAPT (0.44) MAPTSMN1; SMN2ALDH1A1KDM4ERPA1
SCHEMBL10360682 0.86 MAPT (0.43) MAPTSMN1; SMN2ALDH1A1KDM4E
SCHEMBL10360673 0.86 MEN1 (0.44) MAPTSMN1; SMN2ALDH1A1KDM4ERPA1
SCHEMBL10361334 0.86 TSHR (0.44) MAPTSMN1; SMN2ALDH1A1KDM4EHSD17B10
SCHEMBL10361312 0.86 MAPT (0.56) MAPTSMN1; SMN2ALDH1A1KDM4EKMT2A
SCHEMBL10361364 0.85 MAPT (0.42) MAPTSMN1; SMN2ALDH1A1KDM4EMEN1
SCHEMBL10360706 0.85 MAPT (0.43) MAPTSMN1; SMN2ALDH1A1KDM4EHSD17B10
SCHEMBL10361120 0.84 HPGD (0.39) MAPTSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL10361341 0.82 HPGD (0.39) MAPTSMN1; SMN2ALDH1A1KDM4EKMT2A
SCHEMBL10360302 0.82 NOTUM (0.43) MAPTALDH1A1PTGDR2MEN1KMT2A

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
US-4931083-A Plant growth regulating triazoles ELI LILLY AND COMPANY (US) 1990-06-05 US disclosed
EP-0227284-A1 Plant Growth regulating triazoles ELI LILLY AND COMPANY (US) 1987-07-01 EP disclosed