SCHEMBL9403985

SCHEMBL9403985

CCN(CC)S(=O)(=O)c1cc(CCC(=O)C(=[N+]=[N-])C(=O)CCc2ccc(C)c(S(=O)(=O)N(CC)CC)c2)ccc1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.43
TSHR P16473 4/20 0.43
RAB9A P51151 4/20 0.43
NPC1 O15118 3/20 0.43
TP53 P04637 3/20 0.43
MAPK1 P28482 3/20 0.43
ALDH1A1 P00352 8/20 0.41
LMNA P02545 6/20 0.41
PKM P14618 1/20 0.41
HTT P42858 1/20 0.40
MAPT P10636 4/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
KDM4E B2RXH2 1/20 0.39
POLB P06746 1/20 0.38
RECQL P46063 1/20 0.38
PAX8 Q06710 1/20 0.38
MCL1 Q07820 1/20 0.38

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
SCHEMBL9404004 0.84 POLB (0.43) SMN1; SMN2ALDH1A1LMNAHTTMAPT
SCHEMBL9403996 0.83 ALDH1A1 (0.35) SMN1; SMN2ALDH1A1LMNAHTTKMT2A
Ammonia Solution, Strong SCHEMBL9404030 0.83 POLB (0.42) SMN1; SMN2ALDH1A1LMNAHTTMAPT
SCHEMBL9403992 0.82 LMNA (0.49) SMN1; SMN2RAB9ANPC1MAPK1ALDH1A1
SCHEMBL9404009 0.81 LMNA (0.34) SMN1; SMN2ALDH1A1LMNAMAPTKMT2A
SCHEMBL9404022 0.81 LMNA (0.38) SMN1; SMN2RAB9ANPC1TP53ALDH1A1
SCHEMBL9403993 0.77 HTT (0.45) SMN1; SMN2RAB9ANPC1ALDH1A1LMNA
SCHEMBL9404002 0.71 PLAAT3 (0.37) RAB9AALDH1A1LMNAMAPTL3MBTL1
SCHEMBL9404003 0.71 ALDH1A1 (0.42) ALDH1A1LMNAMAPTKMT2ANPSR1
SCHEMBL8748624 0.70 PLAAT3 (0.49) SMN1; SMN2RAB9ANPC1ALDH1A1LMNA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0323050-B1 Photosensitive compound WAKO PURE CHEM IND LTD (JP) 1994-11-02 EP disclosed
US-5250669-A Thermostability, photoresists WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 1993-10-05 US disclosed
EP-0323050-A2 Photosensitive compound WAKO PURE CHEMICAL INDUSTRIES LTD (JP) 1989-07-05 EP disclosed