SCHEMBL22659115

SCHEMBL22659115

Cn1nc(C(F)(F)F)cc1NC(=O)c1ccc2cc(-c3ccc(O)cc3)cnc2c1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ESR2 Q92731 1/20 0.45
▸ STIM1 Q13586 1/20 0.41
▸ ORAI1 Q96D31 1/20 0.41
▸ HPGDS O60760 1/20 0.39
▸ BRAF P15056 3/20 0.39
▸ NTRK1 P04629 1/20 0.38
▸ PDGFRB P09619 2/20 0.38
▸ PDGFRA P16234 2/20 0.38
▸ WDR5 P61964 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ MET P08581 1/20 0.37
▸ MAPK14 Q16539 1/20 0.37
▸ WNT1 P04628 1/20 0.36
▸ GSK3B P49841 1/20 0.36
▸ DYRK1A Q13627 1/20 0.36
▸ KCNT1 Q5JUK3 1/20 0.36
▸ HDAC4 P56524 1/20 0.36

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
SCHEMBL22659083 0.92 HTR2C (0.44) STIM1ORAI1HPGDSBRAFNTRK1
SCHEMBL22659336 0.92 HTR2C (0.44) STIM1ORAI1HPGDSBRAFNTRK1
SCHEMBL29406420 0.91 NTRK1 (0.47) STIM1ORAI1HPGDSBRAFNTRK1
SCHEMBL24571213 0.91 NTRK1 (0.47) STIM1ORAI1HPGDSBRAFNTRK1
SCHEMBL24571216 0.90 KCNT1 (0.46) STIM1ORAI1HPGDSBRAFNTRK1
SCHEMBL24571801 0.89 SMN1; SMN2 (0.45) HPGDS
SCHEMBL22659319 0.87 HPGDS (0.42) STIM1ORAI1HPGDSBRAFNTRK1
SCHEMBL29405919 0.87 HPGDS (0.42) STIM1ORAI1HPGDSBRAFNTRK1
SCHEMBL22659317 0.87 KCNT1 (0.47) STIM1ORAI1HPGDSBRAFNTRK1
SCHEMBL22659053 0.87 DYRK1A (0.49) METWNT1GSK3BDYRK1AKCNT1

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 ESR2 76/4885STIM1 2283/4885ORAI1 3561/4885
US-12312337-B2 Compounds and methods for treating cancer AHR, ARNT, HMOX1 ESR2 76/4885STIM1 2283/4885ORAI1 3561/4885

“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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