SCHEMBL10093002

SCHEMBL10093002

CCOC(=O)c1cc(NC(=O)c2ccc(C)cc2)cc(NC(=O)c2ccc(C)cc2)c1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.62
NPC1 O15118 5/20 0.62
GAA P10253 5/20 0.62
SMN1; SMN2 Q16637 4/20 0.62
ALDH1A1 P00352 5/20 0.60
MAPT P10636 4/20 0.60
LMNA P02545 1/20 0.59
MAPK1 P28482 1/20 0.59
KMT2A Q03164 5/20 0.58
MEN1 O00255 3/20 0.58
NPSR1 Q6W5P4 2/20 0.58
TSHR P16473 2/20 0.58
TP53 P04637 1/20 0.58
KDM4E B2RXH2 2/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
HTT P42858 1/20 0.51
FABP1 P07148 1/20 0.51
P2RY14 Q15391 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
SCHEMBL13308506 0.85 ESR1 (0.54) RAB9ANPC1GAASMN1; SMN2ALDH1A1
SCHEMBL1947842 0.83 NPC1 (0.80) RAB9ANPC1GAASMN1; SMN2ALDH1A1
SCHEMBL7232750 0.83 KDM4E (0.74) RAB9ANPC1GAAALDH1A1MAPT
SCHEMBL10943445 0.82 RAB9A (0.88) RAB9ANPC1GAASMN1; SMN2ALDH1A1
SCHEMBL5879030 0.82 RAB9A (0.88) RAB9ANPC1GAASMN1; SMN2ALDH1A1
SCHEMBL31114086 0.80 RAB9A (0.60) RAB9ANPC1GAASMN1; SMN2ALDH1A1
SCHEMBL6673464 0.79 RAB9A (0.59) RAB9ANPC1GAASMN1; SMN2ALDH1A1
SCHEMBL16270607 0.79 P2RY14 (0.75) RAB9ANPC1GAASMN1; SMN2MAPT
SCHEMBL31114172 0.79 RAB9A (0.55) RAB9ANPC1GAASMN1; SMN2ALDH1A1
SCHEMBL2350063 0.79 MAPK14 (0.64) RAB9ANPC1GAASMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120088888-A1 POLYIMIDE PRECURSOR, POLYIMIDE, AND LIQUID CRYSTAL ALIGNING AGENT NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2012-04-12 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-20120088888-A1 POLYIMIDE PRECURSOR, POLYIMIDE, AND LIQUID CRYSTAL ALIGNING AGENT PUF60, F13A1, F12 RAB9A 1123/4885NPC1 4839/4885GAA 4561/4885

“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.