SCHEMBL21884653

SCHEMBL21884653

N=C(N)NC(=O)c1cc(Br)ccc1O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAU P00749 2/20 0.61
F2 P00734 1/20 0.61
F10 P00742 1/20 0.61
PLAT P00750 1/20 0.61
HPGD P15428 3/20 0.55
ALOX15 P16050 2/20 0.55
CES2 O00748 1/20 0.55
GALR3 O60755 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP2C9 P11712 1/20 0.55
CASP1 P29466 1/20 0.55
CYP2C19 P33261 1/20 0.55
GAA P10253 6/20 0.51
MAPT P10636 4/20 0.51
KMT2A Q03164 5/20 0.48
MEN1 O00255 4/20 0.48
KDM4E B2RXH2 3/20 0.48
HTT P42858 2/20 0.48
POLB P06746 1/20 0.48
TMPRSS4 Q9NRS4 1/20 0.48

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
SCHEMBL23875335 0.80 P2RX1 (0.57) MAPTKMT2AMEN1TMPRSS4
SCHEMBL21884644 0.80 PPIA (0.50) PLAUF2F10PLATHPGD
SCHEMBL2724103 0.79 HPGD (0.62) PLAUF2F10PLATHPGD
Bromocyl SCHEMBL678320 0.78 HPGD (0.67) PLAUF2F10PLATHPGD
SCHEMBL8445926 0.78 PLAU (0.48) PLAUF2F10PLATHTT
SCHEMBL21884580 0.76 PLAU (0.53) PLAUF2F10PLATHPGD
SCHEMBL21884658 0.76 TMPRSS4 (0.50) HPGDCES2KMT2AMEN1KDM4E
Hydrochloric Acid SCHEMBL8445397 0.76 F10 (0.47) PLAUF2F10PLATKMT2A
SCHEMBL21884643 0.76 TMPRSS4 (0.51) PLAUF2F10PLATCASP1
SCHEMBL5743479 0.76 ALOX15 (0.57) PLAUF2F10PLATHPGD

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 PLAU 986/4885F2 4663/4885F10 4684/4885
US-20210371403-A1 SMALL MOLECULES TARGETING MUTANT MAMMALIAN PROTEINS SNRPE, G3BP1, G3BP2 PLAU 3975/4885F2 4520/4885F10 4139/4885

“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.