SCHEMBL21884403

SCHEMBL21884403

N#Cc1ccc(O)c(C(=O)NC(=N)N)c1Oc1cccc(F)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 1/20 0.36
F10 P00742 4/20 0.35
KLKB1 P03952 1/20 0.34
EGLN2 Q96KS0 1/20 0.34
EGLN1 Q9GZT9 1/20 0.34
FNTA P49354 1/20 0.34
FNTB P49356 1/20 0.34
PGGT1B P53609 1/20 0.34
GCK P35557 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
PPIA P62937 2/20 0.33
USP2 O75604 1/20 0.33
KMT2A Q03164 1/20 0.33
VEGFA P15692 1/20 0.32
KCNH2 Q12809 1/20 0.32
SCN3A Q9NY46 1/20 0.32
F2 P00734 1/20 0.32
CDC7 O00311 1/20 0.32
DYRK3 O43781 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
SCHEMBL21884604 0.87 KDM4E (0.38) F10F2
SCHEMBL21884551 0.81 PARP10 (0.36) SLC22A12EGLN2EGLN1NPC1RAB9A
SCHEMBL21884651 0.80 AR (0.40) EGLN1PPIAMAP4K4
SCHEMBL23854892 0.77 LRRK2 (0.38) F10USP2F2
SCHEMBL21884517 0.76 HSD17B1 (0.34)
SCHEMBL23854851 0.75 PPIA (0.36) PPIA
SCHEMBL21884499 0.74 SMN1; SMN2 (0.34) F10NPC1RAB9AF2
SCHEMBL23854842 0.74 PPIA (0.35) PPIA
SCHEMBL21885702 0.74 PPIA (0.35) PPIAKMT2A
SCHEMBL21884575 0.73 CNR2 (0.36)

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-20210371403-A1 SMALL MOLECULES TARGETING MUTANT MAMMALIAN PROTEINS JNANA THERAPEUTICS INC. 2021-12-02 US disclosed
US-20210371403-A1 SMALL MOLECULES TARGETING MUTANT MAMMALIAN PROTEINS JNANA THERAPEUTICS INC. 2021-12-02 US disclosed
US-20210299070-A1 METHODS OF TREATING CREATINE TRANSPORTER DEFICIENCY JNANA THERAPEUTICS INC. 2021-09-30 US disclosed
US-20210299070-A1 METHODS OF TREATING CREATINE TRANSPORTER DEFICIENCY JNANA THERAPEUTICS INC. 2021-09-30 US disclosed
WO-2020061473-A1 SMALL MOLECULES TARGETING MUTANT MAMMALIAN PROTEINS JNANA THERAPEUTICS, INC. (US) 2020-03-26 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-20210299070-A1 METHODS OF TREATING CREATINE TRANSPORTER DEFICIENCY SLC19A1, SLC1A5, SLC1A2 SLC22A12 58/4885F10 4684/4885KLKB1 436/4885
US-20210371403-A1 SMALL MOLECULES TARGETING MUTANT MAMMALIAN PROTEINS SNRPE, G3BP1, G3BP2 SLC22A12 3945/4885F10 4139/4885KLKB1 3567/4885

“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.