SCHEMBL15947758

SCHEMBL15947758

Cc1ccc(OC[C@H](O)CNc2cc[nH]c(=O)c2-c2nc3cc4c(cc3[nH]2)C(=O)N(CCCN2CCCC2)C4)c(C)c1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 16/20 0.42
CYP3A4 P08684 14/20 0.42
NTRK1 P04629 3/20 0.42
RET P07949 3/20 0.42
ROS1 P08922 3/20 0.42
ACVRL1 P37023 3/20 0.42
NTRK3 Q16288 2/20 0.42
NTRK2 Q16620 2/20 0.42
MET P08581 1/20 0.42
PTK2 Q05397 2/20 0.39
INSR P06213 1/20 0.39
AURKA O14965 1/20 0.39
AURKB Q96GD4 1/20 0.39
ALK Q9UM73 1/20 0.39

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
SCHEMBL767938 0.97 NTRK1 (0.45) IGF1RCYP3A4NTRK1RETROS1
SCHEMBL767939 0.97 NTRK1 (0.45) IGF1RCYP3A4NTRK1RETROS1
SCHEMBL768426 0.96 NTRK1 (0.43) IGF1RCYP3A4NTRK1RETROS1
SCHEMBL767684 0.91 IGF1R (0.44) IGF1RCYP3A4NTRK1RETROS1
SCHEMBL767683 0.91 IGF1R (0.44) IGF1RCYP3A4NTRK1RETROS1
SCHEMBL774061 0.89 NTRK1 (0.43) IGF1RCYP3A4NTRK1RETROS1
SCHEMBL767559 0.88 NTRK1 (0.42) IGF1RCYP3A4NTRK1RETROS1
SCHEMBL772593 0.87 NTRK1 (0.47) IGF1RCYP3A4NTRK1RETROS1
SCHEMBL768792 0.87 NTRK1 (0.44) IGF1RCYP3A4NTRK1RETROS1
SCHEMBL10283915 0.87 NTRK1 (0.44) IGF1RCYP3A4NTRK1RETROS1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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-20140228350-A1 TRICYCLIC COMPOUND DERIVATIVES USEFUL IN THE TREATMENT OF NEOPLASTIC DISEASES, INFLAMMATORY DISORDERS AND IMMUNOMODULATORY DISORDERS MALT1, TPMT, TSLP IGF1R 2381/4885CYP3A4 1201/4885NTRK1 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.