SCHEMBL7165686

SCHEMBL7165686

CCOC(=O)c1cc(C)c(NC(=O)OCc2ccccc2)c(C)c1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.57
NPC1 O15118 1/20 0.57
NAMPT P43490 2/20 0.52
SMN1; SMN2 Q16637 3/20 0.51
MAOA P21397 1/20 0.50
KMT2A Q03164 2/20 0.49
GAA P10253 1/20 0.49
SLC6A2 P23975 1/20 0.49
SLC6A3 Q01959 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
MGLL Q99685 1/20 0.48
MAPT P10636 2/20 0.47
NLRP3 Q96P20 2/20 0.47
POLB P06746 1/20 0.47
CASP3 P42574 1/20 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
SCHEMBL28564954 0.85 NPC1 (0.64) RAB9ANPC1SMN1; SMN2MAOAMGLL
SCHEMBL16088310 0.82 NPC1 (0.61) RAB9ANPC1SMN1; SMN2MAOAMGLL
SCHEMBL20389370 0.81 NAMPT (0.76) RAB9ANPC1NAMPTSMN1; SMN2KMT2A
SCHEMBL4872967 0.80 NAMPT (0.51) RAB9ANPC1NAMPTSMN1; SMN2KMT2A
SCHEMBL17997751 0.80 NPC1 (0.58) RAB9ANPC1SMN1; SMN2MAOAMGLL
SCHEMBL3041603 0.77 NPC1 (0.58) RAB9ANPC1SMN1; SMN2MAOAMGLL
SCHEMBL8726462 0.77 NAMPT (0.70) RAB9ANPC1NAMPTSMN1; SMN2KMT2A
SCHEMBL7336549 0.77 SMN1; SMN2 (0.61) RAB9ANPC1NAMPTSMN1; SMN2KMT2A
SCHEMBL11408485 0.77 KMT2A (0.76) RAB9ANPC1NAMPTSMN1; SMN2MAOA
SCHEMBL7169757 0.76 MAPT (0.50) RAB9ANPC1SMN1; SMN2KMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030171376-A1 Antiarthritic agents CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-09-11 US disclosed
US-6559149-B1 Lesser side effects without compromise in their efficacy CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-05-06 US disclosed
EP-0632038-B1 METHOTREXATE DERIVATIVE CHUGAI PHARMACEUTICAL CO LTD (JP) 2001-08-22 EP disclosed
EP-0632038-A1 METHOTREXATE DERIVATIVE Chugai Seiyaku Kabushiki Kaisha (JP) 1995-01-04 EP 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-20030171376-A1 Antiarthritic agents BCOR, RCOR1, IL4 RAB9A 2339/4885NPC1 2566/4885NAMPT 4497/4885

“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.