SCHEMBL22659199

SCHEMBL22659199

Cn1nc(C(C)(C)C)cc1NC(=O)c1ccc2cc(-c3ccccc3F)cnc2c1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ BRAF P15056 11/20 0.46
▸ KDM1A O60341 1/20 0.42
▸ MAPK14 Q16539 4/20 0.42
▸ MAPK13 O15264 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ MAPK12 P53778 1/20 0.40
▸ MAPK11 Q15759 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ GRIN2B Q13224 1/20 0.39
▸ TRPV1 Q8NER1 1/20 0.39
▸ NTRK1 P04629 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
SCHEMBL29403296 1.00 BRAF (0.46) BRAFKDM1AMAPK14MAPK13MAPT
SCHEMBL24571432 0.93 NTRK1 (0.42) BRAFMAPTRAB9AGRIN2BNTRK1
SCHEMBL22659007 0.91 BRAF (0.45) BRAFKDM1AMAPK14MAPK13MAPT
SCHEMBL22659082 0.88 MAPK14 (0.53) BRAFKDM1AMAPK14MAPK13MAPT
SCHEMBL22659162 0.86 BRAF (0.47) BRAFKDM1AMAPK14GRIN2B
SCHEMBL29405932 0.86 BRAF (0.47) BRAFKDM1AMAPK14GRIN2B
SCHEMBL22659352 0.83 NTRK1 (0.42) BRAFMAPK14NTRK1
SCHEMBL22659123 0.83 NTRK1 (0.49) GRIN2BNTRK1
SCHEMBL22659859 0.83 NTRK1 (0.42) BRAFMAPTRAB9ANTRK1
SCHEMBL29405116 0.83 NTRK1 (0.42) BRAFMAPTRAB9ANTRK1

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-12312337-B2 Compounds and methods for treating cancer ANTIDOTE IP HOLDINGS, LLC (US) 2025-05-27 — — US disclosed
US-20220204482-A1 COMPOUNDS AND METHODS FOR TREATING CANCER ANTIDOTE IP HOLDINGS, LLC 2022-06-30 — — US disclosed
US-20220204482-A1 COMPOUNDS AND METHODS FOR TREATING CANCER ANTIDOTE IP HOLDINGS, LLC 2022-06-30 — — US disclosed
EP-3966208-A2 COMPOUNDS AND METHODS FOR TREATING CANCER Antidote IP Holdings, LLC (US) 2022-03-16 — — EP disclosed
WO-2020231739-A2 COMPOUNDS AND METHODS FOR TREATING CANCER ANTIDOTE IP HOLDINGS, LLC (US) 2020-11-19 — — 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 (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-20220204482-A1 COMPOUNDS AND METHODS FOR TREATING CANCER AHR, ARNT, HMOX1 BRAF 1104/4885KDM1A 926/4885MAPK14 2425/4885
US-12312337-B2 Compounds and methods for treating cancer AHR, ARNT, HMOX1 BRAF 1104/4885KDM1A 926/4885MAPK14 2425/4885

“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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