SCHEMBL378875

SCHEMBL378875

NCc1cc(F)ccc1Oc1ccc2c(cnn2CCO)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 1/20 0.53
ABL1 P00519 1/20 0.53
NTRK1 P04629 1/20 0.53
FYN P06241 1/20 0.53
LYN P07948 1/20 0.53
RET P07949 1/20 0.53
BCR P11274 1/20 0.53
FGFR1 P11362 1/20 0.53
BRAF P15056 1/20 0.53
EPHA1 P21709 1/20 0.53
EPHA2 P29317 1/20 0.53
ABL2 P42684 1/20 0.53
FRK P42685 1/20 0.53
MAPK9 P45984 1/20 0.53
MAPKAPK2 P49137 1/20 0.53
IRAK1 P51617 1/20 0.53
MAPK10 P53779 1/20 0.53
EPHB3 P54753 1/20 0.53
EPHB4 P54760 1/20 0.53
CDK5 Q00535 1/20 0.53

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 SCHEMBL3775833 0.99 MAP4K4 (0.52) MAP4K4ABL1NTRK1FYNLYN
SCHEMBL15995520 0.91 MAP4K4 (0.54) MAP4K4ABL1NTRK1FYNLYN
SCHEMBL17407525 0.89 MAP4K4 (0.59) MAP4K4ABL1NTRK1FYNLYN
SCHEMBL9967319 0.89 MAP4K4 (0.45) MAP4K4ABL1NTRK1FYNLYN
SCHEMBL16004750 0.88 MAP4K4 (0.58) MAP4K4ABL1NTRK1FYNLYN
SCHEMBL15995698 0.88 MAP4K4 (0.43) MAP4K4ABL1NTRK1FYNLYN
SCHEMBL23600476 0.86 MAP4K4 (0.58) MAP4K4ABL1NTRK1FYNLYN
SCHEMBL2446819 0.86 MAPK14 (0.45) MAP4K4ABL1NTRK1FYNLYN
SCHEMBL30411917 0.85 MAP4K4 (0.61) MAP4K4ABL1NTRK1FYNLYN
SCHEMBL17407527 0.84 LYN (0.52) MAP4K4ABL1NTRK1FYNLYN

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 49 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2819998-B1 CRYSTALLINE FORMS OF 1-(3-TERT-BUTYL-1-P-TOLYL-1H-PYRAZOL-5-YL)-3-(5-FLUORO-2-(1-(2-HYDROXYETHYL)-1H-INDAZOL-5-YLOXY)BENZYL)UREA HYDROCHLORIDE ARRAY BIOPHARMA INC (US) 2022-04-06 EP claimed
US-9278936-B2 Crystalline forms of 1-(3-tert-butyl-1-p-tolyl-1H-pyrazol-5-yl)-3-(5-fluoro-2-(1-(2-hydroxyethyl)-1H-indazol-5-yloxy)benzyl)urea hydrochloride ARRAY BIOPHARMA INC. (US) 2016-03-08 US claimed
US-20150030673-A1 CRYSTALLINE FORMS OF 1-(3-TERT-BUTYL-1-P-TOLYL-1H-PYRAZOL-5-YL)-3-(5-FLUORO-2-(1-(2-HYDROXYETHYL)-INDAZOL-5-YLOXY)BENZYL)UREA HYDROCHLORIDE ARRAY BIOPHARMA INC. (US) 2015-01-29 US claimed
EP-2819998-A1 CRYSTALLINE FORMS OF 1- (3 -TERT-BUTYL- 1 - P-TOLYL- 1H- PYRAZOL- 5 -YL) -3- (5-FLUORO-2- (1- ( 2 - HYDROXYETHYL) - INDAZOL- 5 -YLOXY) BENZYL) UREA HYDROCHLORIDE Array Biopharma, Inc. (US) 2015-01-07 EP claimed
WO-2013130573-A1 CRYSTALLINE FORMS OF 1- (3 -TERT-BUTYL- 1 - P-TOLYL- 1H- PYRAZOL- 5 -YL) -3- (5-FLUORO-2- (1- ( 2 - HYDROXYETHYL) - INDAZOL- 5 -YLOXY) BENZYL) UREA HYDROCHLORIDE ARRAY BIOPHARMA INC. (US) 2013-09-06 WO claimed
EP-4101844-A1 CRYSTALLINE FORM OF 1-(3-TERT-BUTYL-1-P-TOLYL-1H-PYRAZOL-5-YL)-3-(5-FLUORO-2-(1-(2-HYDROXYETHYL)-1H-INDAZOL-5-YLOXY)BENZYL)UREA HYDROCHLORIDE Array BioPharma Inc. (US) 2022-12-14 EP disclosed
EP-4101844-A1 CRYSTALLINE FORM OF 1-(3-TERT-BUTYL-1-P-TOLYL-1H-PYRAZOL-5-YL)-3-(5-FLUORO-2-(1-(2-HYDROXYETHYL)-1H-INDAZOL-5-YLOXY)BENZYL)UREA HYDROCHLORIDE Array BioPharma Inc. (US) 2022-12-14 EP disclosed
EP-2819998-B1 CRYSTALLINE FORMS OF 1-(3-TERT-BUTYL-1-P-TOLYL-1H-PYRAZOL-5-YL)-3-(5-FLUORO-2-(1-(2-HYDROXYETHYL)-1H-INDAZOL-5-YLOXY)BENZYL)UREA HYDROCHLORIDE ARRAY BIOPHARMA INC (US) 2022-04-06 EP 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-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
EP-2961744-B1 INTERMEDIATES FOR USE IN THE PREPARATION OF INDAZOLE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF ARRAY BIOPHARMA INC (US) 2017-06-28 EP disclosed
US-20100331385-A1 PYRAZOLE UREA DERIVATIVES USED AS KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2010-12-30 US disclosed
CN-101415685-A Kinase inhibitors and methods of use thereof ARRAY BIOPHARMA INC (US) 2009-04-22 CN disclosed
US-20090023795-A1 Kinase Inhibitors And Methods Of Use Thereof ARRAY BIOPHARMA, INC. 2009-01-22 US disclosed
US-20090023795-A1 Kinase Inhibitors And Methods Of Use Thereof ARRAY BIOPHARMA, INC. 2009-01-22 US disclosed
US-20090023795-A1 Kinase Inhibitors And Methods Of Use Thereof ARRAY BIOPHARMA, INC. 2009-01-22 US disclosed
EP-1981851-A1 KINASE INHIBITORS AND METHODS OF USE THEREOF Array Biopharma, Inc. (US) 2008-10-22 EP disclosed
WO-2007089646-A1 KINASE INHIBITORS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2007-08-09 WO disclosed
WO-2007089646-A1 KINASE INHIBITORS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2007-08-09 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 (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-20150030673-A1 CRYSTALLINE FORMS OF 1-(3-TERT-BUTYL-1-P-TOLYL-1H-PYRAZOL-5-YL)-3-(5-FLUORO-2-(1-(2-HYDROXYETHYL)-INDAZOL-5-YLOXY)BENZYL)UREA HYDROCHLORIDE TTR, HK1, REN MAP4K4 3141/4885ABL1 462/4885NTRK1 3592/4885
US-20090023795-A1 Kinase Inhibitors And Methods Of Use Thereof MAP3K1, MAP3K19, MAP3K20 MAP4K4 31/4885ABL1 28/4885NTRK1 807/4885
US-20100331385-A1 PYRAZOLE UREA DERIVATIVES USED AS KINASE INHIBITORS MAP3K1, MAP3K19, MAP3K13 MAP4K4 47/4885ABL1 138/4885NTRK1 2725/4885

“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.