SCHEMBL7872436

SCHEMBL7872436

Cc1nc2cccc3n(CCCCNS(=O)(=O)c4ccccc4)c(=O)c1n23

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.44
PKM P14618 2/20 0.44
KDM4E B2RXH2 1/20 0.44
LMNA P02545 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HTR1A P08908 2/20 0.40
HTR7 P34969 3/20 0.40
MAPK1 P28482 1/20 0.39
TBXA2R P21731 1/20 0.39
GAA P10253 1/20 0.37
TSHR P16473 1/20 0.37
CYP24A1 Q07973 1/20 0.36
EPHX2 P34913 1/20 0.36
HTT P42858 1/20 0.36
DRD2 P14416 1/20 0.36
HTR2A P28223 1/20 0.36
HTR6 P50406 1/20 0.36

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 SCHEMBL7870354 0.99 ALDH1A1 (0.43) ALDH1A1PKMKDM4ELMNASMN1; SMN2
SCHEMBL7872398 0.87 TDP1 (0.42) ALDH1A1HTT
SCHEMBL7868943 0.87 MEN1 (0.38) ALDH1A1HTR1AHTT
Hydrochloric Acid SCHEMBL7871546 0.86 TDP1 (0.41) ALDH1A1HTT
Hydrochloric Acid SCHEMBL7871692 0.86 MEN1 (0.37) ALDH1A1HTR1AHTT
SCHEMBL7871625 0.84 TDP1 (0.38) ALDH1A1HTT
SCHEMBL7871755 0.84 EPHX1 (0.35) ALDH1A1KDM4EHTT
Hydrochloric Acid SCHEMBL7870671 0.84 HRH1 (0.34) ALDH1A1KDM4EHTT
Hydrochloric Acid SCHEMBL7870301 0.83 TDP1 (0.38) ALDH1A1HTT
SCHEMBL7872380 0.83 HTT (0.32) ALDH1A1KDM4EHTT

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 4 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
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 ALDH1A1 2398/4885PKM 3816/4885KDM4E 834/4885

“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.