SCHEMBL424832

SCHEMBL424832

CC1(C)COCN1C(=O)n1nnc2cc(C(=O)NO)ccc21

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.41
RAB9A P51151 4/20 0.39
MAPT P10636 4/20 0.39
POLB P06746 2/20 0.39
HDAC6 Q9UBN7 6/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPK1 P28482 1/20 0.38
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
AHR P35869 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HCAR3 P49019 1/20 0.36

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
SCHEMBL426112 0.89 MAPT (0.55) HPGDRAB9AMAPTPOLBMEN1
SCHEMBL424826 0.88 HCAR3 (0.49) HPGDHCAR3
SCHEMBL428178 0.87 RAB9A (0.56) HPGDRAB9AMAPTPOLBMEN1
SCHEMBL427200 0.87 NAMPT (0.45) HPGDMAPTKMT2AALDH1A1KDM4E
SCHEMBL426119 0.86 HPGD (0.51) HPGDRAB9AMAPTPOLBALDH1A1
SCHEMBL427885 0.85 ADORA3 (0.45) HPGDRAB9AMAPTPOLBMEN1
SCHEMBL427274 0.82 RAB9A (0.40) RAB9AMAPTMEN1KMT2ANPC1
SCHEMBL427962 0.82 KCNMA1 (0.48) RAB9AMEN1KMT2AKDM4ENPC1
SCHEMBL7906239 0.81 KCNMA1 (0.37) HPGDRAB9AMAPTPOLBALDH1A1
SCHEMBL427401 0.81 MAPT (0.47) HPGDRAB9AMAPTPOLBMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9353082-B2 Pharmaceutical compounds BIAL—PORTELA & CA, S.A. (PT) 2016-05-31 US disclosed
US-9353082-B2 Pharmaceutical compounds BIAL—PORTELA & CA, S.A. (PT) 2016-05-31 US disclosed
US-20120065191-A1 PHARMACEUTICAL COMPOUNDS BIAL - PORTELA & Cª, S.A. (PT) 2012-03-15 US disclosed
US-20120065191-A1 PHARMACEUTICAL COMPOUNDS BIAL - PORTELA & Cª, S.A. (PT) 2012-03-15 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 (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-20120065191-A1 PHARMACEUTICAL COMPOUNDS FAAH, FAAH2, ASAH1 HPGD 247/4885RAB9A 2266/4885MAPT 1705/4885

“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.