SCHEMBL21743166

SCHEMBL21743166

CC(C)(C)C(=O)Nc1cccnn1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.47
FFAR2 O15552 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
GOT1 P17174 1/20 0.46
ADORA1 P30542 2/20 0.44
KDM4E B2RXH2 3/20 0.43
POLB P06746 2/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
SIRT2 Q8IXJ6 1/20 0.42
CETP P11597 1/20 0.41
TSHR P16473 1/20 0.40
KMT2A Q03164 1/20 0.40
NPSR1 Q6W5P4 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
SCHEMBL1430882 0.79 GOT1 (0.50) L3MBTL1FFAR2CYP1A2GOT1ADORA1
SCHEMBL19116736 0.78 ADORA1 (0.48) FFAR2GOT1ADORA1KDM4EPOLB
SCHEMBL31038470 0.78 NAMPT (0.46) FFAR2GOT1NPC1RAB9ASIRT2
SCHEMBL4093611 0.78 NAMPT (0.46) FFAR2GOT1NPC1RAB9ASIRT2
SCHEMBL14120037 0.77 GOT1 (0.57) FFAR2GOT1NPC1RAB9ASIRT2
SCHEMBL921576 0.77 L3MBTL1 (0.54) L3MBTL1CYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL15348825 0.77 GOT1 (0.52) FFAR2CYP1A2GOT1ADORA1NPC1
SCHEMBL29517383 0.76 KDM4E (0.65) L3MBTL1ADORA1KDM4EPOLBNPC1
SCHEMBL510126 0.76 KDM4E (0.65) L3MBTL1ADORA1KDM4EPOLBNPC1
SCHEMBL20606962 0.76 FFAR2 (0.48) FFAR2GOT1ADORA1POLBNPC1

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-20230364086-A1 COMBINATION THERAPIES WITH EHMT2 INHIBITORS Epizyme, Inc. 2023-11-16 US disclosed
US-11672800-B2 Combination therapies with EHMT2 inhibitors Epizyme, Inc. (US) 2023-06-13 US disclosed
US-20200317642-A1 AMINE-SUBSTITUTED HETEROCYCLIC COMPOUNDS AS EHMT2 INHIBITORS AND DERIVATIVES THEREOF Epizyme, Inc. 2020-10-08 US disclosed
US-20200113901-A1 METHODS OF USING EHMT2 INHIBITORS Epizyme, Inc. 2020-04-16 US disclosed
US-20200054635-A1 COMBINATION THERAPIES WITH EHMT2 INHIBITORS Epizyme, Inc. 2020-02-20 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 (5 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-20230364086-A1 COMBINATION THERAPIES WITH EHMT2 INHIBITORS EHMT2, BHMT, SHMT2 L3MBTL1 1359/4885FFAR2 3205/4885CYP1A2 2958/4885
US-20200317642-A1 AMINE-SUBSTITUTED HETEROCYCLIC COMPOUNDS AS EHMT2 INHIBITORS AND DERIVATIVES THEREOF HNMT, EHMT2, SHMT2 L3MBTL1 2833/4885FFAR2 1866/4885CYP1A2 1253/4885
US-20200054635-A1 COMBINATION THERAPIES WITH EHMT2 INHIBITORS EHMT2, BHMT, SHMT2 L3MBTL1 1359/4885FFAR2 3205/4885CYP1A2 2958/4885
US-20200113901-A1 METHODS OF USING EHMT2 INHIBITORS EHMT2, EHMT1, BHMT L3MBTL1 436/4885FFAR2 3025/4885CYP1A2 1159/4885
US-11672800-B2 Combination therapies with EHMT2 inhibitors EHMT2, BHMT, SHMT2 L3MBTL1 1359/4885FFAR2 3205/4885CYP1A2 2958/4885

“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.