SCHEMBL9284205

SCHEMBL9284205

Cc1c(Cl)c(C(CO)CO)c(F)c(OCc2ccccc2)c1C(=O)Oc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.42
PRKCA P17252 2/20 0.36
PRKCD Q05655 2/20 0.36
GLRA1 P23415 1/20 0.35
MRGPRX4 Q96LA9 3/20 0.35
LMNA P02545 1/20 0.35
HPGD P15428 1/20 0.35
MCL1 Q07820 2/20 0.35
KDM4E B2RXH2 1/20 0.35
BAK1 Q16611 1/20 0.34
PTGER1 P34995 1/20 0.33
PTGER4 P35408 1/20 0.33
PTGER3 P43115 1/20 0.33
PTGER2 P43116 1/20 0.33
POLB P06746 1/20 0.33
MAOB P27338 1/20 0.33

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
SCHEMBL18525122 0.88 PTPN1 (0.42) PTPN1GLRA1MRGPRX4LMNAHPGD
SCHEMBL9287286 0.88 PTPN1 (0.40) PTPN1PRKCAPRKCDGLRA1MRGPRX4
SCHEMBL20803895 0.87 PTPN1 (0.42) PTPN1GLRA1MRGPRX4LMNAHPGD
SCHEMBL18750612 0.86 PTPN1 (0.40) PTPN1PRKCAPRKCDGLRA1LMNA
SCHEMBL9278579 0.84 PTPN1 (0.38) PTPN1PRKCAPRKCDGLRA1LMNA
SCHEMBL9283033 0.79 PTPN1 (0.40) PTPN1GLRA1MRGPRX4LMNAHPGD
SCHEMBL12108742 0.78 PTPN1 (0.42) PTPN1GLRA1MRGPRX4LMNAHPGD
SCHEMBL9285361 0.78 MCL1 (0.41) PTPN1PRKCAPRKCDGLRA1MRGPRX4
SCHEMBL20370139 0.78 PTPN1 (0.45) PTPN1LMNAHPGDMAOB
SCHEMBL18525117 0.78 PTPN1 (0.40) PTPN1GLRA1MRGPRX4LMNAHPGD

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-20170044160-A1 TETRACYCLINE COMPOUNDS TETRAPHASE PHARMACEUTICALS, INC. 2017-02-16 US disclosed
US-9315451-B2 Tetracycline compounds TETRAPHASE PHARMACEUTICALS, INC. (US) 2016-04-19 US disclosed
US-20120135968-A1 Tetracycline Compounds TETRAPHASE PHARMACEUTICALS, INC. 2012-05-31 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 (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-20170044160-A1 TETRACYCLINE COMPOUNDS TUBB, TUBA1C, TUBA1A PTPN1 402/4885PRKCA 4379/4885PRKCD 4247/4885
US-20120135968-A1 Tetracycline Compounds TUBB, TUBA1C, TUBA1A PTPN1 402/4885PRKCA 4379/4885PRKCD 4247/4885

“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.