SCHEMBL9282987

SCHEMBL9282987

C=Cc1c(F)c(F)c(C)c(C(=O)Oc2ccccc2)c1OCc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.40
LMNA P02545 2/20 0.38
HPGD P15428 1/20 0.38
BRD4 O60885 1/20 0.37
RAB9A P51151 3/20 0.37
NPC1 O15118 2/20 0.37
NR1H4 Q96RI1 1/20 0.37
KMT2A Q03164 1/20 0.37
MAOB P27338 2/20 0.36
MAPT P10636 3/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
STAT1 P42224 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL18524982 0.90 PTPN1 (0.41) PTPN1LMNAHPGDRAB9ANPC1
SCHEMBL9282794 0.88 PTPN1 (0.38) PTPN1LMNAHPGDBRD4RAB9A
SCHEMBL20370139 0.83 PTPN1 (0.45) PTPN1LMNAHPGDBRD4RAB9A
SCHEMBL18523741 0.83 PTPN1 (0.46) PTPN1LMNAHPGDBRD4RAB9A
SCHEMBL9283183 0.83 KCNA3 (0.43) PTPN1LMNAHPGDKMT2AMAOB
SCHEMBL17692799 0.83 PTPN1 (0.39) PTPN1LMNAHPGDBRD4RAB9A
SCHEMBL24926429 0.81 PTPN1 (0.36) PTPN1LMNAHPGDBRD4RAB9A
SCHEMBL18766383 0.81 PTPN1 (0.38) PTPN1LMNAHPGDBRD4RAB9A
SCHEMBL12108837 0.81 PTPN1 (0.38) PTPN1LMNAHPGDMAOB
SCHEMBL9282938 0.81 PTPN1 (0.45) PTPN1LMNAHPGDKMT2AMAOB

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 402/4885LMNA 3089/4885HPGD 2557/4885
US-20120135968-A1 Tetracycline Compounds TUBB, TUBA1C, TUBA1A PTPN1 402/4885LMNA 3089/4885HPGD 2557/4885

“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.