SCHEMBL26426730

SCHEMBL26426730

CC(C)(C)c1ccc(-c2ccccn2)cc1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ PDK2 Q15119 1/20 0.43
▸ CYP11B2 P19099 2/20 0.42
▸ TRPV1 Q8NER1 1/20 0.41
▸ CYP1A2 P05177 2/20 0.41
▸ LMNA P02545 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ CCR1 P32246 1/20 0.41
▸ CCR5 P51681 1/20 0.41
▸ CCR8 P51685 1/20 0.41
▸ METAP1 P53582 1/20 0.41
▸ BLM P54132 1/20 0.41
▸ HIF1A Q16665 1/20 0.41
▸ DOHH Q9BU89 1/20 0.41
▸ P4HTM Q9NXG6 1/20 0.41
▸ SQOR Q9Y6N5 1/20 0.40
▸ ABL1 P00519 1/20 0.40

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
SCHEMBL19072645 0.85 CYP11B2 (0.57) KDM4EALDH1A1MAPK1RAB9APDK2
SCHEMBL26424745 0.82 KDM4E (0.45) KDM4EALDH1A1RAB9APDK2TRPV1
SCHEMBL23525619 0.81 TRPV1 (0.41) KDM4EALDH1A1MAPK1RAB9APDK2
SCHEMBL160064 0.79 KDM4E (0.67) KDM4EALDH1A1MAPK1RAB9APDK2
SCHEMBL23253142 0.78 KDM4E (0.50) KDM4EALDH1A1MAPK1RAB9APDK2
SCHEMBL11124529 0.77 ALDH1A1 (0.46) KDM4EALDH1A1RAB9APDK2TRPV1
SCHEMBL2754785 0.77 PIK3CD (0.46) KDM4EPDK2TRPV1CYP1A2LMNA
SCHEMBL14062416 0.76 ALOX5AP (0.41) RAB9ACYP11B2CYP11B1
SCHEMBL15853152 0.75 KIF11 (0.47) CYP11B2CYP11B1
SCHEMBL30704714 0.75 KMO (0.52) KDM4EALDH1A1MAPK1RAB9APDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230130909-A1 HPK1 INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF Wigen Biomedicine Technology (shanghai) Co., Ltd. (CN) 2023-04-27 — — US 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 (1 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-20230130909-A1 HPK1 INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF WEE2, WEE1, HK1 KDM4E 3982/4885ALDH1A1 3279/4885MAPK1 162/4885

“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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