SCHEMBL12136709

SCHEMBL12136709

CCCCCCCCCCCC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.65
LMNA P02545 2/20 0.56
NPC1 O15118 1/20 0.56
RAB9A P51151 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
ALDH1A1 P00352 4/20 0.54
HTT P42858 1/20 0.54
KDM4E B2RXH2 4/20 0.54
HPGD P15428 1/20 0.53
ALOX12 P18054 1/20 0.53
P2RY12 Q9H244 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
POLB P06746 2/20 0.52
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
MCL1 Q07820 1/20 0.52
GAA P10253 1/20 0.51
MAPK1 P28482 1/20 0.51

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
SCHEMBL12136711 0.93 MAPT (0.58) MAPTLMNANPC1RAB9ASMN1; SMN2
SCHEMBL18687248 0.89 MAPT (0.76) MAPTLMNANPC1ALDH1A1HTT
SCHEMBL14947264 0.83 MAPT (0.48) MAPTLMNANPC1RAB9ASMN1; SMN2
SCHEMBL12136712 0.82 EPHX1 (0.65) MAPTALDH1A1HTTMEN1KMT2A
SCHEMBL12136699 0.81 MAPT (0.52) MAPTLMNARAB9AALDH1A1HTT
SCHEMBL12136703 0.81 MAPT (0.52) MAPTLMNARAB9AALDH1A1HTT
SCHEMBL14947263 0.80 MAPT (0.51) MAPTRAB9AALDH1A1HTTKDM4E
SCHEMBL14947262 0.80 MAPT (0.51) MAPTRAB9AALDH1A1HTTKDM4E
SCHEMBL9858666 0.79 ENPP2 (0.71) LMNANPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL675018 0.79 ENPP2 (0.71) LMNANPC1RAB9ASMN1; SMN2ALDH1A1

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-8362270-B2 Self-assembled nanostructures XEROX CORPORATION (US) 2013-01-29 US disclosed
US-20110282072-A1 SELF-ASSEMBLED NANOSTRUCTURES NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2011-11-17 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110282072-A1 SELF-ASSEMBLED NANOSTRUCTURES RB1, CNKSR1, RBBP4 MAPT 3230/4885LMNA 787/4885NPC1 3979/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.