SCHEMBL17407528

SCHEMBL17407528

N=Cc1cc(Oc2ccc(F)cc2C(N)C(N)c2cc(F)ccc2Oc2ccc3c(cnn3CCO)c2)ccc1NCCO

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NTRK1 P04629 2/20 0.40
▸ MAP4K4 O95819 1/20 0.40
▸ ABL1 P00519 1/20 0.40
▸ FYN P06241 1/20 0.40
▸ LYN P07948 1/20 0.40
▸ RET P07949 1/20 0.40
▸ BCR P11274 1/20 0.40
▸ FGFR1 P11362 1/20 0.40
▸ BRAF P15056 1/20 0.40
▸ EPHA1 P21709 1/20 0.40
▸ EPHA2 P29317 1/20 0.40
▸ ABL2 P42684 1/20 0.40
▸ FRK P42685 1/20 0.40
▸ MAPK9 P45984 1/20 0.40
▸ MAPKAPK2 P49137 1/20 0.40
▸ IRAK1 P51617 1/20 0.40
▸ MAPK10 P53779 1/20 0.40
▸ EPHB3 P54753 1/20 0.40
▸ EPHB4 P54760 1/20 0.40
▸ CDK5 Q00535 1/20 0.40

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
SCHEMBL16004751 0.85 HTR2A (0.37) HTR2AKCNH2
SCHEMBL378875 0.72 MAP4K4 (0.53) NTRK1MAP4K4ABL1FYNLYN
SCHEMBL14436458 0.72 SLC6A4 (0.38) HTR2AKCNH2
SCHEMBL17407527 0.72 LYN (0.52) NTRK1MAP4K4ABL1FYNLYN
SCHEMBL15995520 0.72 MAP4K4 (0.54) NTRK1MAP4K4ABL1FYNLYN
Hydrochloric Acid SCHEMBL3775833 0.72 MAP4K4 (0.52) NTRK1MAP4K4ABL1FYNLYN
SCHEMBL16004750 0.72 MAP4K4 (0.58) NTRK1MAP4K4ABL1FYNLYN
SCHEMBL17407525 0.71 MAP4K4 (0.59) NTRK1MAP4K4ABL1FYNLYN
SCHEMBL23600476 0.70 MAP4K4 (0.58) NTRK1MAP4K4ABL1FYNLYN
SCHEMBL19057964 0.70 AR (0.41) —

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-9790206-B2 Intermediates for use in the preparation of indazole derivatives and processes for the preparation thereof ARRAY BIOPHARMA INC. (US) 2017-10-17 — — US disclosed
US-9790206-B2 Intermediates for use in the preparation of indazole derivatives and processes for the preparation thereof ARRAY BIOPHARMA INC. (US) 2017-10-17 — — US disclosed
US-20160002210-A1 INTERMEDIATES FOR USE IN THE PREPARATION OF INDAZOLE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF ARRAY BIOPHARMA INC. (US) 2016-01-07 — — US disclosed
US-20160002210-A1 INTERMEDIATES FOR USE IN THE PREPARATION OF INDAZOLE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF ARRAY BIOPHARMA INC. (US) 2016-01-07 — — 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-20160002210-A1 INTERMEDIATES FOR USE IN THE PREPARATION OF INDAZOLE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF CYP3A7, CYP3A5, CYP3A43 NTRK1 4380/4885MAP4K4 1332/4885ABL1 329/4885

“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.

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