SCHEMBL7870372

SCHEMBL7870372

Cc1nc2cccc3n(CCCCCNC(=O)C(F)(F)F)c(=O)c1n23

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
EPHX1 P07099 1/20 0.37
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
DRD2 P14416 5/20 0.34
DRD4 P21917 5/20 0.34
HTR1A P08908 2/20 0.34
HTT P42858 1/20 0.34
FAAH O00519 4/20 0.34
BRD4 O60885 2/20 0.33
CA12 O43570 1/20 0.33
CA2 P00918 1/20 0.33
CA3 P07451 1/20 0.33
CA4 P22748 1/20 0.33
CA6 P23280 1/20 0.33
CA5A P35218 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33

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
SCHEMBL7868688 0.99 ALDH1A1 (0.37) MEN1KMT2AEPHX1ALDH1A1POLB
Hydrochloric Acid SCHEMBL7871764 0.98 ALDH1A1 (0.36) MEN1KMT2AEPHX1ALDH1A1POLB
SCHEMBL7872441 0.92 DRD2 (0.33) DRD2DRD4HTR1AHTTFAAH
SCHEMBL7863439 0.91 DRD2 (0.34) DRD2DRD4HTR1AHTTFAAH
SCHEMBL7863443 0.85 FAAH (0.38) HTR1AHTTFAAHBRD4STING1
Hydrochloric Acid SCHEMBL7872445 0.84 FAAH (0.38) DRD2HTR1AHTTFAAHBRD4
SCHEMBL7872390 0.83 TDP1 (0.32) ALDH1A1POLBHTT
SCHEMBL7871580 0.83 TDP1 (0.32) ALDH1A1POLBHTT
SCHEMBL7875380 0.83 HTR1A (0.48) MEN1KMT2AALDH1A1POLBSMN1; SMN2
Hydrochloric Acid SCHEMBL7871630 0.82 TDP1 (0.32) HTT

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 2 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

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 MEN1 1493/4885KMT2A 971/4885EPHX1 393/4885

“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.