SCHEMBL21885702

SCHEMBL21885702

N#Cc1ccc(O)c(C(=O)NC(=N)N)c1-c1cc(F)ccc1Cl

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPIA P62937 2/20 0.35
PYGL P06737 2/20 0.33
TAS1R3 Q7RTX0 1/20 0.32
TAS1R1 Q7RTX1 1/20 0.32
TAS1R2 Q8TE23 1/20 0.32
P2RX1 P51575 1/20 0.32
RORC P51449 1/20 0.32
KCNQ3 O43525 1/20 0.31
KCNQ2 O43526 1/20 0.31
KCNE1 P15382 1/20 0.31
KCNQ1 P51787 1/20 0.31
AR P10275 2/20 0.31
CASP1 P29466 1/20 0.31
S1PR3 Q99500 2/20 0.31
CCNT1 O60563 1/20 0.31
CDK9 P50750 1/20 0.31
S1PR2 O95136 1/20 0.31
S1PR4 O95977 1/20 0.31
P2RX7 Q99572 1/20 0.31
TMPRSS4 Q9NRS4 1/20 0.30

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
SCHEMBL21884417 0.92 PPIA (0.35) PPIAPYGLTAS1R3TAS1R1TAS1R2
SCHEMBL21884530 0.89 TMPRSS4 (0.40) PPIAP2RX1S1PR3P2RX7TMPRSS4
SCHEMBL23854851 0.89 PPIA (0.36) PPIATAS1R3TAS1R1TAS1R2P2RX1
SCHEMBL21884399 0.87 GAA (0.35) PPIAS1PR3S1PR2S1PR4MEN1
SCHEMBL23854842 0.87 PPIA (0.35) PPIACCNT1CDK9
SCHEMBL21884460 0.87 BIRC5 (0.40) PPIAP2RX1ARP2RX7TMPRSS4
SCHEMBL21884664 0.85 F2 (0.37) S1PR3MEN1GAAKMT2A
SCHEMBL21885734 0.85 CCNT1 (0.42) ARCCNT1CDK9
SCHEMBL21884434 0.84 L3MBTL1 (0.38) PPIATAS1R3TAS1R1TAS1R2AR
SCHEMBL21884641 0.84 TMPRSS4 (0.40) PPIATAS1R3TAS1R1TAS1R2P2RX1

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 PPIA 1961/4885PYGL 274/4885TAS1R3 4172/4885
US-20210371403-A1 SMALL MOLECULES TARGETING MUTANT MAMMALIAN PROTEINS SNRPE, G3BP1, G3BP2 PPIA 2399/4885PYGL 2138/4885TAS1R3 4710/4885

“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.