SCHEMBL7871598

SCHEMBL7871598

Cc1cn2c(CO)cccc2n1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.38
KDM4E B2RXH2 4/20 0.37
KMT2A Q03164 3/20 0.36
ALDH1A1 P00352 3/20 0.36
MAPK1 P28482 1/20 0.35
NPSR1 Q6W5P4 2/20 0.34
HSD17B10 Q99714 1/20 0.34
RAB9A P51151 5/20 0.33
NPC1 O15118 2/20 0.33
MAPT P10636 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MEN1 O00255 1/20 0.33
F10 P00742 1/20 0.32
TP53 P04637 2/20 0.32
HTT P42858 1/20 0.32

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
Hydrochloric Acid SCHEMBL7871563 0.81 HTT (0.35) GAAKDM4EKMT2AALDH1A1MAPK1
SCHEMBL7870289 0.79 RAB9A (0.37) GAAKDM4EKMT2AALDH1A1RAB9A
SCHEMBL8811947 0.76 KMT2A (0.39) GAAKDM4EKMT2AALDH1A1MAPK1
SCHEMBL7947747 0.75 GAA (0.50) GAAKDM4EKMT2AALDH1A1RAB9A
SCHEMBL7875511 0.75 FGFR1 (0.53) KDM4EKMT2AALDH1A1HSD17B10RAB9A
SCHEMBL118407 0.75 GAA (0.73) GAAKDM4EKMT2AALDH1A1MAPK1
SCHEMBL3448499 0.72 PDE10A (0.41) GAAKDM4EKMT2AALDH1A1RAB9A
SCHEMBL15004601 0.72 RAB9A (0.38) GAAKDM4EKMT2AALDH1A1NPSR1
SCHEMBL8373773 0.72 ALDH1A1 (0.40) GAAKDM4EKMT2AALDH1A1NPSR1
SCHEMBL542463 0.72 NPC1 (0.37) GAAKDM4EKMT2AALDH1A1NPSR1

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 5 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
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 3830/4885KDM4E 834/4885KMT2A 971/4885

“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.