SCHEMBL7875400

SCHEMBL7875400

O=S(=O)(NCCCCN1Cc2cccc3ncc(n23)C1)C(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.36
MEN1 O00255 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
NPY5R Q15761 1/20 0.35
HTR7 P34969 13/20 0.35
HTR6 P50406 11/20 0.35
EPHX1 P07099 1/20 0.35
HTR2A P28223 6/20 0.34
DRD2 P14416 5/20 0.34
HTR1A P08908 1/20 0.33
L3MBTL1 Q9Y468 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
SCHEMBL7871610 0.99 NPY5R (0.37) IDO1MEN1HTTKMT2ANPY5R
Hydrochloric Acid SCHEMBL7872353 0.99 IDO1 (0.35) IDO1MEN1HTTKMT2ANPY5R
Hydrochloric Acid SCHEMBL7868680 0.98 NPY5R (0.36) IDO1MEN1HTTKMT2ANPY5R
SCHEMBL7872422 0.97 IDO1 (0.36) IDO1MEN1HTTKMT2ANPY5R
Hydrochloric Acid SCHEMBL7870239 0.96 IDO1 (0.36) IDO1MEN1HTTKMT2ANPY5R
SCHEMBL5270073 0.82 IDO1 (0.34) IDO1MEN1HTTKMT2ANPY5R
SCHEMBL7871633 0.82 EPHX1 (0.35) IDO1NPY5RHTR7HTR6EPHX1
Hydrochloric Acid SCHEMBL7863539 0.81 EPHX1 (0.34) IDO1NPY5RHTR7HTR6EPHX1
Hydrochloric Acid SCHEMBL7875513 0.81 IDO1 (0.34) IDO1MEN1HTTKMT2ANPY5R
SCHEMBL7871569 0.81 IDO1 (0.34) IDO1MEN1HTTKMT2ANPY5R

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 IDO1 795/4885MEN1 1493/4885HTT 710/4885

“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.