SCHEMBL25701933

SCHEMBL25701933

O=C1CN(c2cnn(PI)c(=O)c2Cl)CCN1c1ccc(C(F)(F)F)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 1/20 0.41
▸ KMT2A Q03164 1/20 0.36
▸ DHFR P00374 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.34
▸ MAPT P10636 2/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ FNTA P49354 2/20 0.34
▸ PGGT1B P53609 2/20 0.34
▸ TRPC5 Q9UL62 3/20 0.34
▸ P2RX7 Q99572 1/20 0.34
▸ KCNH2 Q12809 1/20 0.34
▸ TRPC4 Q9UBN4 1/20 0.34
▸ CA12 O43570 3/20 0.33
▸ CA1 P00915 3/20 0.33
▸ CA2 P00918 3/20 0.33
▸ CA9 Q16790 3/20 0.33
▸ DCTPP1 Q9H773 2/20 0.33
▸ FNTB P49356 1/20 0.33
▸ GRM2 Q14416 1/20 0.32
▸ AKR1C3 P42330 1/20 0.32

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
SCHEMBL20818376 0.77 ACHE (0.37) ACHEKMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL20818359 0.77 TRPC5 (0.56) ALDH1A1TRPC5KCNH2TRPC4
SCHEMBL20831820 0.71 TRPC5 (0.49) ALDH1A1MAPTSMN1; SMN2TRPC5P2RX7
SCHEMBL20831960 0.70 TRPC5 (0.61) KMT2AALDH1A1SMN1; SMN2TRPC5P2RX7
SCHEMBL20831621 0.69 RAB9A (0.33) KMT2AALDH1A1MAPTSMN1; SMN2CA12
SCHEMBL25706100 0.69 RAB9A (0.39) KMT2AALDH1A1MAPTSMN1; SMN2CA12
SCHEMBL25703537 0.68 HSD17B13 (0.38) ALDH1A1MAPTTRPC5P2RX7TP53
SCHEMBL25701752 0.67 TRPC5 (0.60) TRPC5P2RX7KCNH2TRPC4
SCHEMBL25703193 0.66 TRPC5 (0.51) ALDH1A1TRPC5P2RX7KCNH2TRPC4
SCHEMBL20831457 0.65 TRPC5 (0.55) ALDH1A1MAPTTRPC5KCNH2TRPC4

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-20230203028-A1 PYRIDAZINONES AND METHODS OF USE THEREOF GFB (ABC), LLC 2023-06-29 — — 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-20230203028-A1 PYRIDAZINONES AND METHODS OF USE THEREOF PDXK, ATP6V1B1, REN ACHE 403/4885KMT2A 3397/4885DHFR 93/4885

“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.

Send feedback