SCHEMBL20495651

SCHEMBL20495651

CC(CNCc1ccc(N(C)C)cc1)NCc1ccc(N(C)C)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.51
MEN1 O00255 3/20 0.51
ALDH1A1 P00352 6/20 0.50
TSHR P16473 3/20 0.50
KDM4E B2RXH2 2/20 0.50
MAPK1 P28482 3/20 0.44
TDP1 Q9NUW8 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
CYP3A4 P08684 1/20 0.44
NOS1 P29475 1/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA4 P22748 1/20 0.42
CA9 Q16790 1/20 0.42
SIGMAR1 Q99720 1/20 0.41
MAPT P10636 3/20 0.40
GAA P10253 2/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 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
SCHEMBL11534880 0.84 ALDH1A1 (0.48) KMT2AMEN1ALDH1A1TSHRKDM4E
SCHEMBL19090738 0.82 ALDH1A1 (0.47) KMT2AALDH1A1TSHRKDM4EMAPK1
SCHEMBL13995711 0.81 ALDH1A1 (0.48) KMT2AMEN1ALDH1A1TSHRKDM4E
SCHEMBL17509716 0.81 MAOA (0.47) KMT2AMEN1ALDH1A1TSHRKDM4E
SCHEMBL29501164 0.81 ALDH1A1 (0.45) KMT2AALDH1A1TSHRKDM4EMAPK1
SCHEMBL9843973 0.80 ALDH1A1 (0.52) ALDH1A1TSHRKDM4EMAPK1TDP1
SCHEMBL25588023 0.79 ALDH1A1 (0.44) KMT2AMEN1ALDH1A1TSHRKDM4E
SCHEMBL30945860 0.79 ALDH1A1 (0.61) KMT2AMEN1ALDH1A1TSHRKDM4E
SCHEMBL18909206 0.79 MEN1 (0.54) KMT2AMEN1ALDH1A1TSHRKDM4E
SCHEMBL29787785 0.79 MEN1 (0.54) KMT2AMEN1ALDH1A1TSHRKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230025575-A1 PROCESS FOR PREPARING AMINES OVER A COPPER CATALYST BASF SE (DE) 2023-01-26 US disclosed
EP-4069418-A1 PROCESS FOR PREPARING AMINES OVER A COPPER CATALYST BASF SE (DE) 2022-10-12 EP disclosed
CN-114746179-A Method for producing amines on copper catalysts 巴斯夫欧洲公司 2022-07-12 CN disclosed
US-11225588-B2 Method for producing a curing agent for low-emission epoxy resin compositions SIKA TECHNOLOGY AG (CH) 2022-01-18 US disclosed
EP-3596150-B1 METHOD FOR THE PREPARATION OF A CROSS-LINKER FOR LOW EMISSION EPOXY RESIN COMPOSITIONS SIKA TECH AG (CH) 2021-04-07 EP disclosed
US-20200040215-A1 METHOD FOR PRODUCING A CURING AGENT FOR LOW-EMISSION EPOXY RESIN COMPOSITIONS SIKA TECHNOLOGY AG (CH) 2020-02-06 US disclosed
WO-2018166996-A1 METHOD FOR PRODUCING A CURING AGENT FOR LOW-EMISSION EPOXY RESIN COMPOSITIONS SIKA TECHNOLOGY AG (CH) 2018-09-20 WO disclosed
EP-3375802-A1 METHOD FOR THE PREPARATION OF A CROSS-LINKER FOR LOW EMISSION EPOXY RESIN COMPOSITIONS SIKA TECHNOLOGY AG (CH) 2018-09-19 EP 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-20230025575-A1 PROCESS FOR PREPARING AMINES OVER A COPPER CATALYST AOC2, SOD1, AOC3 KMT2A 224/4885MEN1 1189/4885ALDH1A1 44/4885

“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.