SCHEMBL9435677

SCHEMBL9435677

CC(C)(C)N(C(N)=O)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.45
MAPT P10636 2/20 0.45
MEN1 O00255 4/20 0.44
CYP3A4 P08684 2/20 0.44
CYP2C19 P33261 2/20 0.44
CYP2C9 P11712 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
NPSR1 Q6W5P4 2/20 0.41
ALOX5 P09917 1/20 0.40
ALDH1A1 P00352 4/20 0.39
TSHR P16473 3/20 0.39
GLA P06280 1/20 0.39
POLB P06746 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
PARP1 P09874 1/20 0.38
RECQL P46063 1/20 0.38
BLM P54132 1/20 0.38
PMP22 Q01453 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL7034982 0.83 KMT2A (0.47) KMT2AMAPTMEN1CYP3A4CYP2C19
SCHEMBL10959895 0.83 NPSR1 (0.50) KMT2AMAPTMEN1CYP3A4CYP2C19
SCHEMBL10711856 0.82 KMT2A (0.50) KMT2AMAPTMEN1CYP3A4CYP2C19
SCHEMBL6626142 0.81 KMT2A (0.46) KMT2AMAPTMEN1CYP3A4CYP2C19
SCHEMBL11437979 0.79 KMT2A (0.44) KMT2AMAPTMEN1CYP3A4CYP2C19
SCHEMBL28966867 0.79 ALDH1A1 (0.54) KMT2AMAPTMEN1CYP3A4CYP2C19
SCHEMBL1067570 0.79 NPSR1 (0.41) KMT2AMAPTMEN1CYP3A4CYP2C19
SCHEMBL8599398 0.79 KMT2A (0.41) KMT2AMAPTMEN1CYP3A4CYP2C19
SCHEMBL6037525 0.78 KMT2A (0.41) KMT2AMAPTMEN1CYP3A4CYP2C19
SCHEMBL11676561 0.78 NPSR1 (0.36) KMT2AMAPTMEN1CYP3A4CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4704854-A2 PRMT INHIBITOR COMPOUNDS AND THE USES THEREOF Purdue Research Foundation (US) 2026-03-11 EP disclosed
WO-2024229435-A2 PRMT INHIBITOR COMPOUNDS AND THE USES THEREOF PURDUE RESEARCH FOUNDATION (US) 2024-11-07 WO disclosed
US-10265279-B2 Combinations of LSD1 inhibitors for use in the treatment of solid tumors ORYZON GENOMICS, S.A. (ES) 2019-04-23 US disclosed
US-20190100552-A1 INHIBITORS OF PROTEIN METHYLTRANSFERASE DOT1L AND METHODS OF USE THEREOF Epizyme, Inc. 2019-04-04 US disclosed
US-10112968-B2 Inhibitors of protein methyltransferase DOT1L and methods of use thereof Epizyme, Inc. (US) 2018-10-30 US disclosed
US-20170281567-A1 COMBINATIONS OF LSD1 INHIBITORS FOR USE IN THE TREATMENT OF SOLID TUMORS HOFFMANN-LA ROCHE INC. (US) 2017-10-05 US disclosed
US-20170137455-A1 INHIBITORS OF PROTEIN METHYLTRANSFERASE DOT1L AND METHODS OF USE THEREOF Epizyme, Inc. 2017-05-18 US disclosed
US-20160168185-A1 NON-RIBOSE CONTAINING INHIBITORS OF HISTONE METHYLTRANSFERASE DOT1L FOR CANCER TREATMENT BAYLOR COLLEGE OF MEDICINE (US) 2016-06-16 US disclosed
US-20150284422-A1 INHIBITORS OF PROTEIN METHYLTRANSFERASE DOT1L AND METHODS OF USE THEREOF Epizyme, Inc. 2015-10-08 US disclosed
US-5283362-A Reacting with an amine, terminating the reaction before the formation of by-product CHEMIE LINZ GESELLSCHAFT M.B.H. (AT) 1994-02-01 US disclosed
US-4666529-A Method for reducing combustion chamber deposits from an internal combustion engine SHELL OIL COMPANY (US) 1987-05-19 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 (7 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-20150284422-A1 INHIBITORS OF PROTEIN METHYLTRANSFERASE DOT1L AND METHODS OF USE THEREOF DOT1L, PRMT1, CARM1 KMT2A 28/4885MAPT 130/4885MEN1 2681/4885
US-10265279-B2 Combinations of LSD1 inhibitors for use in the treatment of solid tumors KDM1B, DOT1L, KDM1A KMT2A 14/4885MAPT 3454/4885MEN1 1891/4885
US-10112968-B2 Inhibitors of protein methyltransferase DOT1L and methods of use thereof DOT1L, PRMT1, CARM1 KMT2A 28/4885MAPT 130/4885MEN1 2681/4885
US-20190100552-A1 INHIBITORS OF PROTEIN METHYLTRANSFERASE DOT1L AND METHODS OF USE THEREOF DOT1L, PRMT1, CARM1 KMT2A 28/4885MAPT 130/4885MEN1 2681/4885
US-20170137455-A1 INHIBITORS OF PROTEIN METHYLTRANSFERASE DOT1L AND METHODS OF USE THEREOF DOT1L, PRMT1, CARM1 KMT2A 28/4885MAPT 130/4885MEN1 2681/4885
US-20170281567-A1 COMBINATIONS OF LSD1 INHIBITORS FOR USE IN THE TREATMENT OF SOLID TUMORS KDM1B, DOT1L, KDM1A KMT2A 14/4885MAPT 3454/4885MEN1 1891/4885
US-20160168185-A1 NON-RIBOSE CONTAINING INHIBITORS OF HISTONE METHYLTRANSFERASE DOT1L FOR CANCER TREATMENT DOT1L, CARM1, NSD1 KMT2A 16/4885MAPT 3299/4885MEN1 2460/4885

“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.