SCHEMBL22659168

SCHEMBL22659168

O=C(Nc1ccc(C(F)(F)F)nc1)c1ccc2cc(-c3ccc(F)cc3F)cnc2c1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 2/20 0.48
▸ KCNQ3 O43525 10/20 0.46
▸ KCNQ2 O43526 10/20 0.46
▸ KCNE1 P15382 7/20 0.46
▸ KCNQ1 P51787 7/20 0.46
▸ DGAT2 Q96PD7 1/20 0.45
▸ TRPV1 Q8NER1 1/20 0.45
▸ CNR1 P21554 1/20 0.44
▸ CNR2 P34972 1/20 0.44
▸ HTR2C P28335 1/20 0.43
▸ MCHR1 Q99705 1/20 0.43
▸ PTPN1 P18031 1/20 0.41
▸ PTPN6 P29350 1/20 0.41
▸ PTPN11 Q06124 1/20 0.41

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
SCHEMBL29405937 1.00 KLKB1 (0.48) KLKB1KCNQ3KCNQ2KCNE1KCNQ1
SCHEMBL22659359 0.91 DGAT2 (0.49) KCNQ3KCNQ2KCNE1KCNQ1DGAT2
SCHEMBL29405064 0.91 DGAT2 (0.49) KCNQ3KCNQ2KCNE1KCNQ1DGAT2
SCHEMBL22659842 0.90 MCHR1 (0.51) KCNQ3KCNQ2KCNE1KCNQ1DGAT2
SCHEMBL22659137 0.85 KCNQ3 (0.47) KCNQ3KCNQ2KCNE1KCNQ1DGAT2
SCHEMBL22659373 0.84 BRAF (0.47) DGAT2TRPV1
SCHEMBL29405925 0.84 STIM1 (0.39) KLKB1DGAT2HTR2CMCHR1
SCHEMBL22659804 0.84 STIM1 (0.39) KLKB1DGAT2HTR2CMCHR1
SCHEMBL22659311 0.82 PDGFRB (0.52) KCNQ3KCNQ2KCNE1KCNQ1DGAT2
SCHEMBL22659283 0.82 TRPV1 (0.48) KCNQ3KCNQ2KCNE1KCNQ1DGAT2

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 KLKB1 3484/4885KCNQ3 4135/4885KCNQ2 4299/4885
US-12312337-B2 Compounds and methods for treating cancer AHR, ARNT, HMOX1 KLKB1 3484/4885KCNQ3 4135/4885KCNQ2 4299/4885

“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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