SCHEMBL346797

SCHEMBL346797

O=C(NO)C1CCc2cc(-c3ccc(Cl)cc3)ccc2C1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FAAH O00519 8/20 0.45
NPY5R Q15761 1/20 0.44
MCHR1 Q99705 1/20 0.43
ADRB1 P08588 1/20 0.43
ADRB3 P13945 1/20 0.43
MMP8 P22894 2/20 0.42
MMP3 P08254 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
DGAT1 O75907 1/20 0.40
P2RX7 Q99572 1/20 0.40

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
SCHEMBL435688 0.95 ADRB3 (0.47) FAAHNPY5RADRB1ADRB3MMP8
SCHEMBL461542 0.85 FAAH (0.49) FAAHMCHR1HDAC1HDAC2HDAC6
SCHEMBL434257 0.84 MCHR1 (0.42) MCHR1HDAC8P2RX7
SCHEMBL346051 0.83 CA1 (0.47) FAAHNPY5RMCHR1ADRB1ADRB3
SCHEMBL346480 0.83 FAAH (0.51) FAAHNPY5RMCHR1ADRB1ADRB3
SCHEMBL10260016 0.82 FAAH (0.51) FAAHADRB1ADRB3HDAC1HDAC2
SCHEMBL435997 0.82 HDAC8 (0.48) ADRB1ADRB3HDAC8HDAC6P2RX7
SCHEMBL459845 0.80 FAAH (0.49) FAAHADRB1ADRB3HDAC1HDAC2
SCHEMBL10197679 0.80 FAAH (0.44) FAAHADRB3HDAC1HDAC2HDAC8
SCHEMBL459626 0.79 MTNR1A (0.50) FAAHNPY5RMCHR1CA1CA2

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140243334-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-08-28 US disclosed
US-20140243334-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-08-28 US disclosed
WO-2012012320-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENIUM PHARMACEUTICALS, INC. (US) 2012-01-26 WO disclosed
WO-2012012320-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENIUM PHARMACEUTICALS, INC. (US) 2012-01-26 WO disclosed
US-20120015942-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-01-19 US disclosed
US-20120015942-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-01-19 US disclosed
US-20120015942-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-01-19 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-20120015942-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, HDAC2 FAAH 1791/4885NPY5R 1024/4885MCHR1 3260/4885
US-20140243334-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF HDAC6, H1-3, H1-5 FAAH 651/4885NPY5R 626/4885MCHR1 2145/4885

“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.