SCHEMBL7866205

SCHEMBL7866205

CCc1ccc2c(c1CC)C(c1nc3ccccc3s1)c1ccccc1-2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.40
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
MAPT P10636 2/20 0.37
GAA P10253 2/20 0.37
KDM4E B2RXH2 2/20 0.37
NPC1 O15118 2/20 0.37
ALDH1A1 P00352 2/20 0.37
RAB9A P51151 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
RECQL P46063 1/20 0.37
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 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
SCHEMBL2139183 0.78 MEN1 (0.49) FFAR1MEN1KMT2AMAPTGAA
SCHEMBL7864691 0.73 BACE1 (0.44) FFAR1MEN1KMT2AMAPTGAA
SCHEMBL8063608 0.69 ACHE (0.33) MAPTNPC1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL14940460 0.68 MAPT (0.51) MEN1KMT2AMAPTGAAKDM4E
SCHEMBL11559760 0.64 ACP3 (0.37) MEN1KMT2APOLB
SCHEMBL24182079 0.64 KDM4E (0.63) MEN1KMT2AMAPTGAAKDM4E
SCHEMBL15048484 0.61 NPC1 (0.34) MAPTGAANPC1ALDH1A1RAB9A
SCHEMBL10455243 0.60 HTR2A (0.45) MEN1KMT2ACA1CA2SLC6A2
SCHEMBL12351497 0.60 SMN1; SMN2 (0.46) MEN1KMT2AMAPTGAAKDM4E
SCHEMBL16727584 0.60 UBE2T (0.53) MEN1KMT2AMAPTGAAKDM4E

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
US-6300502-B1 Multi-armed chromophores with very large two-photon absorption cross-sections THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE 2001-10-09 US disclosed