SCHEMBL21884552

SCHEMBL21884552

COc1ccc(F)cc1-c1c(Cl)ccc(OCc2ccccc2)c1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.48
FFAR4 Q5NUL3 1/20 0.48
PTGER1 P34995 2/20 0.47
MRGPRX4 Q96LA9 7/20 0.46
RXRA P19793 2/20 0.46
STK10 O94804 1/20 0.46
SLK Q9H2G2 1/20 0.46
HPGD P15428 3/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
CTSV O60911 2/20 0.44
CTSL P07711 2/20 0.44
SMPD1 P17405 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
MEN1 O00255 1/20 0.44
MITF O75030 1/20 0.44
TP53 P04637 1/20 0.44

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
SCHEMBL23875007 0.86 FFAR4 (0.41) FFAR1FFAR4PTGER1MRGPRX4RXRA
SCHEMBL23875005 0.85 STK10 (0.41) FFAR1FFAR4PTGER1MRGPRX4STK10
SCHEMBL21884805 0.83 STK10 (0.46) FFAR1FFAR4STK10SLKHPGD
SCHEMBL21884553 0.81 STK10 (0.38) FFAR1FFAR4PTGER1STK10SLK
SCHEMBL23875015 0.79 MRGPRX4 (0.46) FFAR1FFAR4PTGER1MRGPRX4RXRA
SCHEMBL1495326 0.74 MRGPRX4 (0.54) PTGER1MRGPRX4RXRAHPGDNPC1
SCHEMBL21667956 0.73 FFAR1 (0.58) FFAR1FFAR4MRGPRX4RXRAHPGD
SCHEMBL30002764 0.73 FFAR1 (0.66) FFAR1FFAR4MRGPRX4RXRASMN1; SMN2
SCHEMBL4228617 0.73 FFAR1 (0.66) FFAR1FFAR4MRGPRX4RXRASMN1; SMN2
SCHEMBL29179278 0.73 MRGPRX4 (0.56) FFAR1FFAR4PTGER1MRGPRX4RXRA

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 3 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-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 FFAR1 2709/4885FFAR4 3825/4885PTGER1 3567/4885
US-20210371403-A1 SMALL MOLECULES TARGETING MUTANT MAMMALIAN PROTEINS SNRPE, G3BP1, G3BP2 FFAR1 4719/4885FFAR4 4834/4885PTGER1 4653/4885

“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.