SCHEMBL15788366

SCHEMBL15788366

Cn1nc(Cl)c2ccn(C)c2c1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARG Q86W56 1/20 0.37
GAA P10253 2/20 0.32
KAT2B Q92831 1/20 0.31
SMN1; SMN2 Q16637 3/20 0.31
NPC1 O15118 2/20 0.31
RAB9A P51151 2/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
ALDH1A1 P00352 2/20 0.31
POLB P06746 2/20 0.31
LMNA P02545 2/20 0.31
KDM4E B2RXH2 1/20 0.31
S1PR2 O95136 1/20 0.31
TDP2 O95551 1/20 0.31
S1PR4 O95977 1/20 0.31
RAF1 P04049 1/20 0.31
MAPT P10636 1/20 0.31
THRB P10828 1/20 0.31
HPGD P15428 1/20 0.31
S1PR1 P21453 1/20 0.31

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
SCHEMBL2070242 0.75 PARG (0.34) PARGSMN1; SMN2NPC1RAB9AMEN1
SCHEMBL17559135 0.72 KAT2B (0.50) PARGKAT2BSMN1; SMN2MEN1KMT2A
SCHEMBL31091769 0.72 KAT2B (0.50) PARGKAT2BSMN1; SMN2MEN1KMT2A
SCHEMBL25072439 0.71 HSD11B1 (0.35) MEN1KMT2AALDH1A1POLB
SCHEMBL30718312 0.71 HSD11B1 (0.35) MEN1KMT2AALDH1A1POLB
SCHEMBL15771064 0.71 DGAT1 (0.36) NPC1ALDH1A1POLBPKM
SCHEMBL7021991 0.69 HDAC1 (0.42) SMN1; SMN2KMT2AALDH1A1POLBLMNA
SCHEMBL12491359 0.67 TRPM8 (0.34)
SCHEMBL17559129 0.67 KAT2B (0.49) PARGGAAKAT2BSMN1; SMN2HPGD
SCHEMBL15069153 0.67 BRD4 (0.51) KAT2BKMT2ABRD9

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-20230158039-A1 BROMODOMAIN INHIBITORS ABBVIE INC (US) 2023-05-25 US disclosed
US-20160143916-A1 BROMODOMAIN INHIBITORS ABBVIE INC (US) 2016-05-26 US disclosed
US-9296741-B2 Bromodomain inhibitors ABBVIE INC. (US) 2016-03-29 US disclosed
US-20140162971-A1 BROMODOMAIN INHIBITORS ABBVIE INC. 2014-06-12 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 (3 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-20140162971-A1 BROMODOMAIN INHIBITORS BRD4, BRD1, BRD3 PARG 2846/4885GAA 1927/4885KAT2B 212/4885
US-20230158039-A1 BROMODOMAIN INHIBITORS BRD4, BRD1, BRD3 PARG 2846/4885GAA 1927/4885KAT2B 212/4885
US-20160143916-A1 BROMODOMAIN INHIBITORS BRD4, BRD1, BRD3 PARG 2846/4885GAA 1927/4885KAT2B 212/4885

“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.