SCHEMBL9130455

SCHEMBL9130455

CCCCCCCCNc1ccc(-c2cc3ccccc3o2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
KDM4E B2RXH2 1/20 0.53
MEN1 O00255 1/20 0.53
ALDH1A1 P00352 1/20 0.53
NFKB1 P19838 1/20 0.53
NPY1R P25929 1/20 0.53
NFKB2 Q00653 1/20 0.53
KMT2A Q03164 1/20 0.53
RELA Q04206 1/20 0.53
MAOB P27338 1/20 0.49
P2RY14 Q15391 1/20 0.47
ADCY6 O43306 2/20 0.47
ADCY3 O60266 2/20 0.47
ADCY9 O60503 2/20 0.47
ADCY5 O95622 2/20 0.47
ADCY8 P40145 2/20 0.47
GCGR P47871 2/20 0.47
ADCY7 P51828 2/20 0.47

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
SCHEMBL9132475 0.95 NPC1 (0.56) NPC1RAB9ASMN1; SMN2KDM4EMEN1
SCHEMBL9130752 0.83 NPC1 (0.61) NPC1RAB9ASMN1; SMN2KDM4EMEN1
SCHEMBL29873244 0.80 MAOB (0.53) NPC1RAB9ASMN1; SMN2KDM4EMEN1
SCHEMBL14832681 0.80 MAOB (0.53) NPC1RAB9ASMN1; SMN2KDM4EMEN1
SCHEMBL9132460 0.79 RAB9A (0.64) NPC1RAB9ASMN1; SMN2KDM4EMEN1
SCHEMBL9133452 0.79 RAB9A (0.64) NPC1RAB9ASMN1; SMN2KDM4EMEN1
SCHEMBL9130460 0.77 MAOB (0.49) NPC1RAB9ASMN1; SMN2KDM4EMEN1
SCHEMBL9131295 0.77 SMN1; SMN2 (0.60) NPC1RAB9ASMN1; SMN2KDM4EMEN1
SCHEMBL424398 0.76 HDAC3 (0.48) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL19719041 0.75 BCHE (0.63) NPC1RAB9ASMN1; SMN2KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5468470-A Radiation resistance and sunscreen agents 3V INC. (US) 1995-11-21 US claimed
EP-0613893-A1 Benzofuran derivatives and the use thereof as stabilizers against UV radiations 3V SIGMA S.p.A (IT) 1994-09-07 EP claimed
US-5468470-A Radiation resistance and sunscreen agents 3V INC. (US) 1995-11-21 US disclosed
US-5362481-A Useful in cosmetics and dermatology 3V INC. (US) 1994-11-08 US disclosed
EP-0613893-A1 Benzofuran derivatives and the use thereof as stabilizers against UV radiations 3V SIGMA S.p.A (IT) 1994-09-07 EP disclosed