SCHEMBL9953124

SCHEMBL9953124

COc1cc(NC(=O)C(=O)c2c(C)n(Cc3ccc(Cl)cc3)c3cc(C)c(OC)cc23)ccn1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.80
MAPT P10636 2/20 0.41
CNR1 P21554 1/20 0.40
P2RX3 P56373 4/20 0.39
PLA2G2A P14555 3/20 0.37
MEN1 O00255 1/20 0.37
RGS12 O14924 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
PKM P14618 1/20 0.37
TSHR P16473 1/20 0.37
NFKB1 P19838 1/20 0.37
MAPK1 P28482 1/20 0.37
CYP2C19 P33261 1/20 0.37
GNAI1 P63096 1/20 0.37
PMP22 Q01453 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL9952543 0.95 FAAH (0.82) FAAHMAPTCNR1P2RX3PLA2G2A
SCHEMBL18877351 0.95 FAAH (0.85) FAAHMAPTCNR1P2RX3PLA2G2A
SCHEMBL9952056 0.93 FAAH (0.80) FAAHMAPTCNR1P2RX3PLA2G2A
SCHEMBL9959333 0.92 FAAH (0.77) FAAHMAPTCNR1P2RX3
SCHEMBL9959484 0.92 FAAH (0.80) FAAHMAPTCNR1P2RX3PLA2G2A
SCHEMBL9952848 0.91 FAAH (0.82) FAAHMAPTCNR1P2RX3PLA2G2A
SCHEMBL9958563 0.90 FAAH (0.65) FAAHMAPTCNR1P2RX3TSHR
SCHEMBL9953106 0.90 FAAH (0.80) FAAHMAPTCNR1P2RX3PLA2G2A
SCHEMBL10244445 0.90 FAAH (0.82) FAAHMAPTCNR1P2RX3PLA2G2A
SCHEMBL2169687 0.90 FAAH (0.91) FAAHMAPTP2RX3PLA2G2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9657012-B2 FAAH inhibitors IRONWOOD PHARMACEUTICALS, INC. (US) 2017-05-23 US disclosed
US-9657012-B2 FAAH inhibitors IRONWOOD PHARMACEUTICALS, INC. (US) 2017-05-23 US disclosed
US-9657012-B2 FAAH inhibitors IRONWOOD PHARMACEUTICALS, INC. (US) 2017-05-23 US disclosed
EP-2655356-B1 FAAH INHIBITORS IRONWOOD PHARMACEUTICALS INC (US) 2016-08-03 EP disclosed
EP-2655356-B1 FAAH INHIBITORS IRONWOOD PHARMACEUTICALS INC (US) 2016-08-03 EP disclosed
US-20150175599-A1 FAAH Inhibitors IRONWOOD PHARMACEUTICALS, INC. (US) 2015-06-25 US disclosed
WO-2014004676-A1 USE OF FAAH INHIBITORS AS NEUROPROTECTIVE AGENTS IN THE CNS IRONWOOD PHARMACEUTICALS, INC. (US) 2014-01-03 WO disclosed
EP-2655356-A1 FAAH INHIBITORS Ironwood Pharmaceuticals, Inc. (US) 2013-10-30 EP disclosed
WO-2012088469-A1 FAAH INHIBITORS IRONWOOD PHARMACEUTICALS, INC. (US) 2012-06-28 WO disclosed
WO-2012088469-A1 FAAH INHIBITORS IRONWOOD PHARMACEUTICALS, INC. (US) 2012-06-28 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-20150175599-A1 FAAH Inhibitors FAAH, FAAH2, ASAH1 FAAH 1/4885MAPT 3363/4885CNR1 22/4885

“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.