SCHEMBL773097

SCHEMBL773097

Cc1cc[nH]c(=O)c1-c1nc2c(C)c3c(c(C)c2[nH]1)CN(CCN1CCCC1)C3=O

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.34
IGF1R P08069 12/20 0.33
NTRK1 P04629 3/20 0.32
ACVRL1 P37023 3/20 0.32
AURKA O14965 1/20 0.32
AURKB Q96GD4 1/20 0.32
ALK Q9UM73 1/20 0.32
RET P07949 1/20 0.32
ROS1 P08922 1/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2B Q13224 1/20 0.32
CYP3A4 P08684 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
SCHEMBL772509 0.95 PARP1 (0.36) PARP1IGF1RNTRK1ACVRL1RET
SCHEMBL772584 0.85 TERT (0.35) IGF1RNTRK1ACVRL1AURKAAURKB
SCHEMBL772916 0.81 IGF1R (0.34) PARP1IGF1RNTRK1ACVRL1CYP3A4
SCHEMBL772581 0.78 NTRK1 (0.49) PARP1IGF1RNTRK1ACVRL1RET
SCHEMBL772913 0.77 NTRK1 (0.42) PARP1IGF1RNTRK1ACVRL1RET
SCHEMBL772905 0.72 NTRK1 (0.49) PARP1IGF1RNTRK1ACVRL1RET
SCHEMBL772497 0.71 NTRK1 (0.41) IGF1RNTRK1ACVRL1RETROS1
SCHEMBL10283981 0.69 NTRK1 (0.46) IGF1RNTRK1ACVRL1RETROS1
SCHEMBL10283983 0.69 NTRK1 (0.46) PARP1NTRK1ACVRL1RETROS1
SCHEMBL13692317 0.66 NTRK1 (0.57) IGF1RNTRK1ACVRL1AURKAAURKB

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-9290503-B2 Tricyclic compound derivatives useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders CHEMBRIDGE CORPORATION (US) 2016-03-22 US disclosed
US-20140228350-A1 TRICYCLIC COMPOUND DERIVATIVES USEFUL IN THE TREATMENT OF NEOPLASTIC DISEASES, INFLAMMATORY DISORDERS AND IMMUNOMODULATORY DISORDERS CHEMBRIDGE CORPORATION (US) 2014-08-14 US disclosed
US-20120071473-A1 TRICYCLIC COMPOUND DERIVATIVES USEFUL IN THE TREATMENT OF NEOPLASTIC DISEASES, INFLAMMATORY DISORDERS AND IMMUNOMODULATORY DISORDERS CHEMBRIDGE CORPORATION 2012-03-22 US disclosed
US-8063225-B2 2-(4-(3-(2,4-Dimethylphenoxy)-2-hydroxypropylamino)-2-oxo-1,2-dihydropyridin-3-yl)-6-(1-methylpiperidin-4-yl)-6,7-dihydroimidazo[4,5-f]isoindol-5(1H)-one; modulating tyrosine kinase; enzyme inhibitors; cancer, diabetes, restenosis, arteriosclerosis, psoriasis, angiogenic diseases, immunologic disorders CHEMBRIDGE CORPORATION (US) 2011-11-22 US disclosed
US-20080171769-A1 Tricyclic compound derivatives useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders CHEMBRIDGE CORPORATION 2008-07-17 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 (3 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-20120071473-A1 TRICYCLIC COMPOUND DERIVATIVES USEFUL IN THE TREATMENT OF NEOPLASTIC DISEASES, INFLAMMATORY DISORDERS AND IMMUNOMODULATORY DISORDERS MALT1, TPMT, TSLP PARP1 2706/4885IGF1R 2381/4885NTRK1 718/4885
US-20140228350-A1 TRICYCLIC COMPOUND DERIVATIVES USEFUL IN THE TREATMENT OF NEOPLASTIC DISEASES, INFLAMMATORY DISORDERS AND IMMUNOMODULATORY DISORDERS MALT1, TPMT, TSLP PARP1 2706/4885IGF1R 2381/4885NTRK1 718/4885
US-20080171769-A1 Tricyclic compound derivatives useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders MALT1, TPMT, TSLP PARP1 2706/4885IGF1R 2381/4885NTRK1 718/4885

“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.