SCHEMBL7863347

SCHEMBL7863347

CCOC(=O)c1cccc2nc(C)cn12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.58
MAPK1 P28482 1/20 0.55
CYP1A2 P05177 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2C19 P33261 2/20 0.47
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
PTGS1 P23219 1/20 0.45
PTGS2 P35354 1/20 0.45
TGFBR1 P36897 1/20 0.45
PDE4A P27815 1/20 0.43
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
TSHR P16473 2/20 0.41
ALDH1A1 P00352 4/20 0.41

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
SCHEMBL21355163 0.83 GAA (0.53) GAAMAPK1CYP1A2SMN1; SMN2CYP2C9
SCHEMBL21816403 0.80 TGFBR1 (0.44) GAAMAPK1SMN1; SMN2NPC1RAB9A
Bromide SCHEMBL2823934 0.78 GAA (0.47) GAAMAPK1CYP1A2SMN1; SMN2CYP2C9
Bromide SCHEMBL2823930 0.77 GAA (0.46) GAAMAPK1CYP1A2SMN1; SMN2CYP2C9
SCHEMBL4125150 0.77 GAA (0.48) GAAMAPK1CYP1A2SMN1; SMN2CYP2C9
SCHEMBL7863436 0.74 MAPK1 (0.49) GAAMAPK1CYP1A2SMN1; SMN2RAB9A
SCHEMBL19697701 0.74 MAPK1 (0.52) GAAMAPK1CYP1A2SMN1; SMN2CYP2C9
SCHEMBL543639 0.74 GAA (0.46) GAAMAPK1CYP1A2SMN1; SMN2CYP2C9
SCHEMBL10257281 0.74 GAA (0.46) GAAMAPK1CYP1A2SMN1; SMN2CYP2C9
SCHEMBL101291 0.73 GAA (1.00) GAAMAPK1CYP1A2SMN1; SMN2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010051631-A1 Tricyclic compounds, their production and use TAKATANI MUNEO (JP) 2001-12-13 US disclosed
US-6251905-B1 Tricyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-06-26 US disclosed
US-5958942-A HAVING EXCELLENT PDGF-INHIBITING ACTIVITIES, ANTIHYPERTENSIVE ACTIVITIES, ACTIVITIES OF AMELIORATING RENAL DISEASES AND ACTIVITIES OF LOWERING LIPID LEVEL. TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-09-28 US disclosed
US-5945188-A INSULATING FILM OF ADHESIVE LAYER, POLYAMIDE RESIN, INORGANIC FILLER, EPOXY RESIN LAYER WITH SILOXANE TOMOEGAWA PAPER CO., LTD. (JP) 1999-08-31 US disclosed
EP-0771319-A1 TRICYCLIC COMPOUNDS, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1997-05-07 EP disclosed
WO-1996002542-A1 TRICYCLIC COMPOUNDS, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-02-01 WO 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-20010051631-A1 Tricyclic compounds, their production and use PDGFA, HGF, REN GAA 3830/4885MAPK1 418/4885CYP1A2 595/4885

“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.