SCHEMBL18087601

SCHEMBL18087601

N#C/C(=C\c1ccc(-c2cc(C(=O)O)ccc2Cl)o1)C(=O)Nc1ccc(F)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.72
KMT2A Q03164 5/20 0.72
POLB P06746 3/20 0.72
NPC1 O15118 2/20 0.72
RAB9A P51151 2/20 0.72
TDP1 Q9NUW8 2/20 0.72
L3MBTL1 Q9Y468 2/20 0.72
SIRT5 Q9NXA8 7/20 0.63
MAPT P10636 3/20 0.61
TP53 P04637 1/20 0.61
BLM P54132 1/20 0.61
EP300 Q09472 1/20 0.58
ATM Q13315 1/20 0.56
PTPN1 P18031 1/20 0.55
KDM4E B2RXH2 1/20 0.54
ALDH1A1 P00352 1/20 0.54
LMNA P02545 1/20 0.54
HSP90AA1 P07900 1/20 0.54
THRB P10828 1/20 0.54
HTT P42858 1/20 0.54

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
SCHEMBL18084859 0.85 MEN1 (0.64) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL38659253 0.83 MAPT (0.77) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL38659652 0.80 MAPT (0.64) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL38660794 0.78 MAPT (0.64) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL28376708 0.78 SIRT5 (0.84) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL38664303 0.77 MAPT (0.58) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL28371840 0.77 SIRT5 (1.00) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL28371417 0.76 SIRT5 (1.00) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL38660339 0.76 MAPT (0.61) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL28376807 0.75 SIRT5 (0.78) MEN1KMT2APOLBNPC1RAB9A

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-20180117043-A1 USE OF SRC PROTEIN INHIBITOR IN THE MANUFACTURE OF A MEDICAMENT FOR THE PROPHYLAXIS AND/OR TREATMENT OF ALZHEIMER'S DISEASE JENKEM TECHNOLOGY CO., LTD. (BEIJING) (CN) 2018-05-03 US disclosed
US-9834530-B2 3-furyl-2-cyano-2-acrylamide derivative, preparation method therefor, pharmaceutical composition and use thereof JENKEM TECHNOLOGY CO., LTD. (BEIJING) (CN) 2017-12-05 US disclosed
EP-3078659-B1 3-FURYL-2-CYANO-2-ACRYLAMIDE DERIVATIVE, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND USE THEREOF JENKEM TECH CO LTD (BEIJING) (CN) 2017-11-15 EP disclosed
EP-3078659-A1 3-FURYL-2-CYANO-2-ACRYLAMIDE DERIVATIVE, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND USE THEREOF Jenkem Technology Co. Ltd. (Beijing) (CN) 2016-10-12 EP disclosed
US-20160272604-A1 3-FURYL-2-CYANO-2-ACRYLAMIDE DERIVATIVE, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND USE THEREOF JENKEM TECHNOLOGY CO., LTD. (BEIJING) (CN) 2016-09-22 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 (2 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-20180117043-A1 USE OF SRC PROTEIN INHIBITOR IN THE MANUFACTURE OF A MEDICAMENT FOR THE PROPHYLAXIS AND/OR TREATMENT OF ALZHEIMER'S DISEASE SRC, FYN, CALM1 MEN1 4625/4885KMT2A 1504/4885POLB 3951/4885
US-20160272604-A1 3-FURYL-2-CYANO-2-ACRYLAMIDE DERIVATIVE, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND USE THEREOF EGFR, ERBB2, ERBB3 MEN1 2035/4885KMT2A 4545/4885POLB 3690/4885

“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.