SCHEMBL5329915

SCHEMBL5329915

CC(C)Nc1c(-c2ccc3c(c2Cl)COC3=O)c(Cl)nc2ncnn12

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.35
TSHR P16473 4/20 0.34
SMN1; SMN2 Q16637 4/20 0.34
L3MBTL1 Q9Y468 3/20 0.34
ALDH1A1 P00352 3/20 0.34
HPGD P15428 3/20 0.34
MAPK1 P28482 3/20 0.34
USP2 O75604 1/20 0.33
POLB P06746 1/20 0.33
CREBBP Q92793 1/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
PKM P14618 1/20 0.31
ALOX15 P16050 1/20 0.30

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
SCHEMBL5495634 0.92 LMNA (0.32) LMNATSHRSMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL5495636 0.92 LMNA (0.32) LMNATSHRSMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL5328145 0.91 AAK1 (0.32) LMNATSHRSMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL5328138 0.91 AAK1 (0.32) LMNATSHRSMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL5331106 0.91 CRHR1 (0.32) LMNATSHRSMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL5328032 0.82 L3MBTL1 (0.32) LMNATSHRSMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL5328026 0.82 L3MBTL1 (0.32) LMNATSHRSMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL5329828 0.82 MBOAT4 (0.33) LMNATSHRSMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL5325221 0.77 LMNA (0.39) LMNATSHRSMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL14270926 0.75 EGLN2 (0.38) LMNATSHRALDH1A1USP2POLB

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
WO-2007147829-A1 AZOLOPYRIMIDINE COMPOUNDS AND THEIR USE FOR CONTROLLING HARMFUL FUNGI BASF SE (DE) 2007-12-27 WO disclosed