SCHEMBL7871701

SCHEMBL7871701

Cc1nc2cccc3c(=O)n(CCCCNS(=O)(=O)C(F)(F)F)c(=O)c1n23

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.34
NPY5R Q15761 1/20 0.33
HTT P42858 2/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
TDP1 Q9NUW8 2/20 0.31
PIN1 Q13526 1/20 0.31
MCL1 Q07820 1/20 0.31
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 1/20 0.31
CYP1A2 P05177 1/20 0.31
POLB P06746 1/20 0.31
HPGD P15428 1/20 0.31
CYP2C19 P33261 1/20 0.31
TLR7 Q9NYK1 1/20 0.30
IDO1 P14902 1/20 0.30
CNR1 P21554 1/20 0.30
CNR2 P34972 1/20 0.30
EGLN1 Q9GZT9 1/20 0.30

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 SCHEMBL7870191 0.99 EPHX1 (0.34) EPHX1NPY5RHTTMEN1KMT2A
SCHEMBL7871755 0.89 EPHX1 (0.35) EPHX1NPY5RHTTTDP1ALDH1A1
SCHEMBL7863469 0.88 EPHX1 (0.37) EPHX1NPY5RHTTTDP1ALDH1A1
Hydrochloric Acid SCHEMBL7863421 0.88 EPHX1 (0.34) EPHX1NPY5RHTTTDP1ALDH1A1
SCHEMBL7871635 0.88 EPHX1 (0.37) EPHX1NPY5RHTTTDP1ALDH1A1
SCHEMBL7863419 0.88 EPHX1 (0.37) EPHX1NPY5RHTTTDP1PIN1
Hydrochloric Acid SCHEMBL7863465 0.87 EPHX1 (0.36) EPHX1NPY5RHTTTDP1ALDH1A1
Hydrochloric Acid SCHEMBL7871603 0.87 EPHX1 (0.36) EPHX1NPY5RHTTTDP1ALDH1A1
SCHEMBL7868647 0.86 EPHX1 (0.33) EPHX1NPY5RHTTALDH1A1KDM4E
Hydrochloric Acid SCHEMBL7870337 0.85 EPHX1 (0.33) EPHX1NPY5RHTTALDH1A1KDM4E

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 EPHX1 393/4885NPY5R 1237/4885HTT 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.