SCHEMBL22659137

SCHEMBL22659137

O=C(Nc1ccc(C(F)(F)F)nc1)c1ccc2cc(-c3ccccc3)cnc2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNQ3 O43525 5/20 0.47
▸ KCNQ2 O43526 5/20 0.47
▸ MCHR1 Q99705 2/20 0.47
▸ HTR2C P28335 1/20 0.47
▸ HDAC4 P56524 1/20 0.47
▸ MMP9 P14780 2/20 0.46
▸ KDR P35968 1/20 0.46
▸ MMP1 P03956 1/20 0.46
▸ TRPV1 Q8NER1 3/20 0.46
▸ KCNE1 P15382 4/20 0.46
▸ KCNQ1 P51787 4/20 0.46
▸ DGAT2 Q96PD7 1/20 0.45
▸ KDM4E B2RXH2 2/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ BRAF P15056 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ MITF O75030 1/20 0.43
▸ XBP1 P17861 1/20 0.43

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
SCHEMBL22659842 0.92 MCHR1 (0.51) KCNQ3KCNQ2MCHR1HTR2CHDAC4
SCHEMBL22659169 0.89 KCNJ11 (0.47) KCNQ3KCNQ2MCHR1MMP9KDR
SCHEMBL22659359 0.89 DGAT2 (0.49) KCNQ3KCNQ2HDAC4TRPV1KCNE1
SCHEMBL29405064 0.89 DGAT2 (0.49) KCNQ3KCNQ2HDAC4TRPV1KCNE1
SCHEMBL22659373 0.88 BRAF (0.47) HDAC4KDRTRPV1DGAT2KDM4E
SCHEMBL22659311 0.86 PDGFRB (0.52) KCNQ3KCNQ2MCHR1HDAC4TRPV1
SCHEMBL22659168 0.85 KLKB1 (0.48) KCNQ3KCNQ2MCHR1HTR2CTRPV1
SCHEMBL29405937 0.85 KLKB1 (0.48) KCNQ3KCNQ2MCHR1HTR2CTRPV1
SCHEMBL22679920 0.85 TRPV1 (0.47) KCNQ3KCNQ2HDAC4TRPV1KCNE1
SCHEMBL22659056 0.85 KCNQ3 (0.50) KCNQ3KCNQ2KDRTRPV1KCNE1

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 6 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
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 KCNQ3 4135/4885KCNQ2 4299/4885MCHR1 584/4885
US-12312337-B2 Compounds and methods for treating cancer AHR, ARNT, HMOX1 KCNQ3 4135/4885KCNQ2 4299/4885MCHR1 584/4885

“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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