SCHEMBL16614288

SCHEMBL16614288

O=C(O)c1cccc(Sc2c(C3CC3)n(CCN3CC4(CCC4)c4ccccc43)c3c(F)c(Cl)ccc23)c1F

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 19/20 0.61
HDAC1 Q13547 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32

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
SCHEMBL17940590 0.94 ENPP2 (0.62) ENPP2HDAC1HDAC8HDAC6
SCHEMBL17943013 0.90 ENPP2 (0.65) ENPP2HDAC1HDAC8HDAC6
SCHEMBL16600615 0.90 ENPP2 (0.73) ENPP2
SCHEMBL16600668 0.90 ENPP2 (0.65) ENPP2HDAC1HDAC8HDAC6
SCHEMBL16614230 0.89 ENPP2 (0.77) ENPP2
SCHEMBL16614305 0.87 ENPP2 (0.69) ENPP2HDAC1HDAC6
SCHEMBL16614270 0.86 ENPP2 (0.78) ENPP2
SCHEMBL16600499 0.86 ENPP2 (0.77) ENPP2
SCHEMBL16600464 0.85 ENPP2 (0.81) ENPP2
SCHEMBL16600666 0.84 ENPP2 (0.65) ENPP2HDAC1HDAC8HDAC6

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-9850203-B2 Autotaxin inhibitor compounds PHARMAKEA, INC. (US) 2017-12-26 US disclosed
US-9850203-B2 Autotaxin inhibitor compounds PHARMAKEA, INC. (US) 2017-12-26 US disclosed
US-20160214935-A1 AUTOTAXIN INHIBITOR COMPOUNDS DF 2024 IP ACQUISITION, LLC 2016-07-28 US disclosed
US-20160214935-A1 AUTOTAXIN INHIBITOR COMPOUNDS DF 2024 IP ACQUISITION, LLC 2016-07-28 US disclosed
WO-2015048301-A1 AUTOTAXIN INHIBITOR COMPOUNDS PHARMAKEA, INC. (US) 2015-04-02 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 (1 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-20160214935-A1 AUTOTAXIN INHIBITOR COMPOUNDS ENPP2, SERPINB1, SERPINE1 ENPP2 1/4885HDAC1 1039/4885HDAC8 919/4885

“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.