SCHEMBL6630458

SCHEMBL6630458

COC(=O)CNc1ccc(OCc2ccccc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.65
NPC1 O15118 5/20 0.65
SMN1; SMN2 Q16637 5/20 0.65
ALDH1A1 P00352 5/20 0.60
LTA4H P09960 3/20 0.57
MEN1 O00255 1/20 0.57
TP53 P04637 1/20 0.57
GAA P10253 1/20 0.57
MAPT P10636 1/20 0.57
BLM P54132 1/20 0.57
KMT2A Q03164 1/20 0.57
ATM Q13315 1/20 0.57
CASP3 P42574 1/20 0.56
SENP8 Q96LD8 1/20 0.56
SENP7 Q9BQF6 1/20 0.56
SENP6 Q9GZR1 1/20 0.56
GPR55 Q9Y2T6 1/20 0.56
MAOB P27338 1/20 0.55
AR P10275 2/20 0.55
HPGD P15428 1/20 0.55

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
SCHEMBL10832371 0.88 NPC1 (0.57) RAB9ANPC1SMN1; SMN2ALDH1A1LTA4H
SCHEMBL5955117 0.87 ALDH1A1 (0.64) RAB9ANPC1SMN1; SMN2ALDH1A1LTA4H
SCHEMBL1799092 0.86 NPC1 (0.61) RAB9ANPC1SMN1; SMN2ALDH1A1LTA4H
SCHEMBL3142683 0.86 RAB9A (0.62) RAB9ANPC1SMN1; SMN2ALDH1A1LTA4H
SCHEMBL8009616 0.85 FFAR1 (0.58) LTA4HMEN1KMT2AMAOBNR4A2
SCHEMBL6629474 0.84 HDAC8 (0.62) RAB9ANPC1SMN1; SMN2ALDH1A1GAA
SCHEMBL8009658 0.81 HPGD (0.58) RAB9ANPC1SMN1; SMN2ALDH1A1MEN1
SCHEMBL810045 0.81 RAB9A (0.63) RAB9ANPC1SMN1; SMN2ALDH1A1MEN1
SCHEMBL11117634 0.81 NPC1 (0.56) RAB9ANPC1SMN1; SMN2ALDH1A1LTA4H
SCHEMBL11453114 0.81 ALDH1A1 (0.56) RAB9ANPC1SMN1; SMN2ALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1027332-B1 NOVEL LACTAM METALLOPROTEASE INHIBITORS BRISTOL MYERS SQUIBB PHARMA CO (US) 2004-05-26 EP disclosed
US-6610731-B2 Antiinflammatory BRISTOL-MYERS SQUIBB COMPANY 2003-08-26 US disclosed
US-20030134827-A1 Novel lactam metalloprotease inhibitors DUAN JINGWU (US) 2003-07-17 US disclosed
US-6403632-B1 CYCLIC AMIDE DERIVATIVE BRISTOL MYERS SQUIBB PHARMA CO (US) 2002-06-11 US disclosed
EP-1027332-A1 NOVEL LACTAM METALLOPROTEASE INHIBITORS Du Pont Pharmaceuticals Company (US) 2000-08-16 EP disclosed
US-6057336-A ANTIINFLAMMATORY AGENTS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2000-05-02 US disclosed
WO-1999018074-A1 NOVEL LACTAM METALLOPROTEASE INHIBITORS Britol-Myers Squibb Pharma Company (US) 1999-04-15 WO disclosed
US-5023255-A Triazine derivatives; inhibitors exzyme 5-lipoxygenase GLAXO GROUP LIMITED (GB) 1991-06-11 US disclosed
US-4985427-A LIPOXYGENASE INHIBITORS GLAXO GROUP LIMITED (GB) 1991-01-15 US disclosed
EP-0388165-A2 Chemical compounds GLAXO GROUP LIMITED (GB) 1990-09-19 EP disclosed
EP-0340030-A2 Triazine derivatives GLAXO GROUP LIMITED (GB) 1989-11-02 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-20030134827-A1 Novel lactam metalloprotease inhibitors ADAM9, ADAM8, ADAM17 RAB9A 922/4885NPC1 1913/4885SMN1; SMN2 2789/4885

“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.