SCHEMBL16095969

SCHEMBL16095969

C=CC(=O)Nc1cc(Br)ccc1N1CCN(C)CC1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EGFR P00533 8/20 0.58
UCHL3 P15374 1/20 0.50
APOBEC3A P31941 1/20 0.49
APOBEC3G Q9HC16 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.48
GAA P10253 3/20 0.46
MAPKAPK2 P49137 2/20 0.46
RXFP1 Q9HBX9 1/20 0.45
BACE1 P56817 1/20 0.43
F13A1 P00488 1/20 0.43
LMNA P02545 1/20 0.43
TGM2 P21980 1/20 0.43
TGM1 P22735 1/20 0.43
TGM3 Q08188 1/20 0.43
WDR5 P61964 1/20 0.43

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
SCHEMBL27361372 0.86 UCHL3 (0.51) EGFRUCHL3SMN1; SMN2GAAMAPKAPK2
SCHEMBL16095355 0.85 EGFR (0.51) EGFRUCHL3SMN1; SMN2GAAMAPKAPK2
SCHEMBL30935288 0.82 UCHL3 (0.48) EGFRUCHL3SMN1; SMN2GAAMAPKAPK2
SCHEMBL16096147 0.81 WDR5 (0.67) GAAWDR5
SCHEMBL30935186 0.78 EGFR (0.48) EGFRUCHL3SMN1; SMN2GAAMAPKAPK2
SCHEMBL30935308 0.77 UCHL3 (0.43) EGFRUCHL3SMN1; SMN2GAAMAPKAPK2
SCHEMBL16099962 0.77 UCHL3 (0.43) EGFRUCHL3SMN1; SMN2GAAMAPKAPK2
SCHEMBL21590250 0.76 APOBEC3A (0.44) APOBEC3AAPOBEC3GSMN1; SMN2GAARXFP1
SCHEMBL22895403 0.76 UCHL3 (0.52) EGFRUCHL3MAPKAPK2
SCHEMBL20605156 0.75 WDR5 (0.70) GAAWDR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110746424-A MK2 inhibitors and uses thereof 西建卡尔有限责任公司 2020-02-04 CN disclosed
US-20190135835-A1 MK2 INHIBITORS AND USES THEREOF BRISTOL-MYERS SQUIBB COMPANY 2019-05-09 US disclosed
US-20190135835-A1 MK2 INHIBITORS AND USES THEREOF BRISTOL-MYERS SQUIBB COMPANY 2019-05-09 US disclosed
US-10138256-B2 MK2 inhibitors and uses thereof CELGENE CAR LLC (BM) 2018-11-27 US disclosed
EP-2968339-A1 MK2 INHIBITORS AND USES THEREOF Celgene Avilomics Research, Inc. (US) 2016-01-20 EP disclosed
US-20150376208-A1 MK2 INHIBITORS AND USES THEREOF CELGENE AVILOMICS RESEARCH, INC. (US) 2015-12-31 US disclosed
US-20150376208-A1 MK2 INHIBITORS AND USES THEREOF CELGENE AVILOMICS RESEARCH, INC. (US) 2015-12-31 US disclosed
US-20150376208-A1 MK2 INHIBITORS AND USES THEREOF CELGENE AVILOMICS RESEARCH, INC. (US) 2015-12-31 US disclosed
WO-2014149164-A1 MK2 INHIBITORS AND USES THEREOF CELGENE AVILOMICS RESEARCH, INC. (US) 2014-09-25 WO disclosed
WO-2014149164-A1 MK2 INHIBITORS AND USES THEREOF CELGENE AVILOMICS RESEARCH, INC. (US) 2014-09-25 WO 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-20150376208-A1 MK2 INHIBITORS AND USES THEREOF MKNK2, DUSP2, MKNK1 EGFR 3184/4885UCHL3 4110/4885APOBEC3A 4883/4885
US-10138256-B2 MK2 inhibitors and uses thereof MKNK2, DUSP2, MKNK1 EGFR 3184/4885UCHL3 4110/4885APOBEC3A 4883/4885
US-20190135835-A1 MK2 INHIBITORS AND USES THEREOF MKNK2, DUSP2, MKNK1 EGFR 3184/4885UCHL3 4110/4885APOBEC3A 4883/4885

“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.