SCHEMBL19019684

SCHEMBL19019684

CS(=O)(=O)O.Nc1ncc(Cl)cc1-c1ccc(Oc2ncc(NC(=O)Nc3cc(C(F)(F)F)ccc3-n3cccn3)cn2)cc1

nearest known ligand 0.93

Known targets — ChEMBL curated mechanism

ABL1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB2AGTR1BCL2BCL2A1BCL2L1BCL2L10BCL2L2BCRBRAFCHRM1CHRNA10CHRNA9DRD1DRD2DRD3DRD4DRD5EGFRF2FLT1FLT4GCKGHSRGNRHRGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHTR1AHTR1BHTR1DHTR2AHTR2CHTR3AIDH2KDRKITMAOBMCL1MTTPPP4HBPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PIKFYVEROCK1ROCK2SLC18A2SLC6A2SLC6A3SLC6A4TACR1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8gyrAgyrBparCparEpol

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 20/20 0.93

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
SCHEMBL15989443 0.97 NTRK1 (1.00) NTRK1
Hydrochloric Acid SCHEMBL19019678 0.96 NTRK1 (0.99) NTRK1
SCHEMBL19019670 0.94 NTRK1 (0.85) NTRK1
SCHEMBL19019654 0.94 NTRK1 (0.87) NTRK1
SCHEMBL17360192 0.92 NTRK1 (1.00) NTRK1
SCHEMBL17360419 0.90 NTRK1 (0.88) NTRK1
SCHEMBL20922180 0.90 NTRK1 (0.84) NTRK1
SCHEMBL17407808 0.89 NTRK1 (1.00) NTRK1
SCHEMBL17360173 0.89 NTRK1 (0.85) NTRK1
SCHEMBL17360471 0.88 NTRK1 (0.83) NTRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3184519-B1 ACID-ADDITION SALT OF TRK-INHIBITING COMPOUND ONO PHARMACEUTICAL CO (JP) 2019-04-24 EP claimed
US-20170240527-A1 ACID-ADDITION SALT OF Trk-INHIBITING COMPOUND ONO PHARMACEUTICAL CO., LTD. (JP) 2017-08-24 US claimed
EP-3184519-A1 ACID-ADDITION SALT OF Trk-INHIBITING COMPOUND ONO Pharmaceutical Co., Ltd. (JP) 2017-06-28 EP claimed
CN-110655502-A Acid addition salts of Trk inhibiting compounds 小野药品工业株式会社 2020-01-07 CN disclosed
US-10399959-B2 Acid-addition salt of Trk-inhibiting compound ONO PHARMACEUTICAL CO., LTD. (JP) 2019-09-03 US disclosed
EP-3184519-B1 ACID-ADDITION SALT OF TRK-INHIBITING COMPOUND ONO PHARMACEUTICAL CO (JP) 2019-04-24 EP disclosed
US-20170240527-A1 ACID-ADDITION SALT OF Trk-INHIBITING COMPOUND ONO PHARMACEUTICAL CO., LTD. (JP) 2017-08-24 US disclosed
EP-3184519-A1 ACID-ADDITION SALT OF Trk-INHIBITING COMPOUND ONO Pharmaceutical Co., Ltd. (JP) 2017-06-28 EP 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 (2 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-20170240527-A1 ACID-ADDITION SALT OF Trk-INHIBITING COMPOUND NTRK1, NGF, NTRK2 NTRK1 1/4885
US-10399959-B2 Acid-addition salt of Trk-inhibiting compound NTRK1, NGF, NTRK2 NTRK1 1/4885

“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.