SCHEMBL4438882

SCHEMBL4438882

CCOc1ccccc1OC(=O)NCc1ccc(OC)cc1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.58
NPC1 O15118 6/20 0.52
LMNA P02545 3/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
HPGD P15428 2/20 0.52
RAB9A P51151 5/20 0.51
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
KDM4E B2RXH2 2/20 0.49
MAPT P10636 2/20 0.49
ALDH1A1 P00352 1/20 0.49
GAA P10253 2/20 0.49
CASR P41180 1/20 0.49
TSHR P16473 1/20 0.49
POLB P06746 1/20 0.49

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
SCHEMBL15334134 0.87 NPC1 (0.66) NPC1SMN1; SMN2RAB9AKMT2AGAA
SCHEMBL15339799 0.86 MEN1 (0.56) FAAHNPC1LMNASMN1; SMN2HPGD
SCHEMBL2722883 0.85 FAAH (0.53) FAAHNPC1LMNASMN1; SMN2HPGD
SCHEMBL4437536 0.85 POLB (0.53) FAAHNPC1LMNAHPGDRAB9A
SCHEMBL2723278 0.85 FAAH (0.57) FAAHNPC1SMN1; SMN2HPGDRAB9A
SCHEMBL2725301 0.83 FAAH (0.60) FAAHNPC1HPGDRAB9AMEN1
SCHEMBL2734060 0.82 FAAH (0.53) FAAHNPC1HPGDRAB9AMEN1
SCHEMBL3275628 0.80 NPC1 (0.72) NPC1LMNASMN1; SMN2HPGDRAB9A
SCHEMBL31321645 0.79 L3MBTL1 (0.56) NPC1LMNASMN1; SMN2HPGDMEN1
SCHEMBL717950 0.79 HPGD (0.63) NPC1LMNAHPGDRAB9AMEN1

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-9249128-B2 Anti-cancer serine hydrolase inhibitory carbamates THE SCRIPPS RESEARCH INSTITUTE (US) 2016-02-02 US disclosed
US-9249128-B2 Anti-cancer serine hydrolase inhibitory carbamates THE SCRIPPS RESEARCH INSTITUTE (US) 2016-02-02 US disclosed
US-20130281453-A1 ANTI-CANCER SERINE HYDROLASE INHIBITORY CARBAMATES THE SCRIPPS RESEARCH INSTITUTE (US) 2013-10-24 US disclosed
US-20130281453-A1 ANTI-CANCER SERINE HYDROLASE INHIBITORY CARBAMATES THE SCRIPPS RESEARCH INSTITUTE (US) 2013-10-24 US disclosed
WO-2012058115-A2 ANTI-CANCER SERINE HYDROLASE INHIBITORY CARBAMATES CRAVATT BENJAMIN (US) 2012-05-03 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-20130281453-A1 ANTI-CANCER SERINE HYDROLASE INHIBITORY CARBAMATES AADAC, DDAH1, PRSS1 FAAH 58/4885NPC1 2821/4885LMNA 4450/4885

“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.