SCHEMBL17540384

SCHEMBL17540384

NC(=O)c1cccc(NC=O)c1F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 12/20 0.44
ALDH1A1 P00352 9/20 0.44
SMN1; SMN2 Q16637 8/20 0.44
NPC1 O15118 7/20 0.44
RAB9A P51151 7/20 0.44
PKM P14618 2/20 0.44
MAPT P10636 5/20 0.42
NFKB1 P19838 4/20 0.42
NFKB2 Q00653 4/20 0.42
RELA Q04206 4/20 0.42
POLB P06746 3/20 0.42
TP53 P04637 3/20 0.42
HSD17B10 Q99714 3/20 0.42
CASP1 P29466 2/20 0.42
RXFP1 Q9HBX9 1/20 0.42
HPGD P15428 3/20 0.41
AGTR1 P30556 1/20 0.40
HTT P42858 1/20 0.40
SIRT2 Q8IXJ6 2/20 0.39
SIRT1 Q96EB6 1/20 0.39

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
SCHEMBL2612359 0.82 KDM4E (0.58) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL1765338 0.81 CXCR2 (0.50) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL31486082 0.81 CXCR2 (0.50) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
Hydrochloric Acid SCHEMBL7424567 0.80 KDM4E (0.57) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
Hydrochloric Acid SCHEMBL7425418 0.80 KDM4E (0.57) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL26345801 0.79 PTPN1 (0.42) TP53RXFP1AGTR1HTTLMNA
SCHEMBL28282536 0.79 KDM4E (0.46) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL27214503 0.77 ALDH1A1 (0.52) KDM4EALDH1A1MAPTHSD17B10HPGD
SCHEMBL17540401 0.76 KDM5A (0.33) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL28932597 0.74 ALDH1A1 (0.39) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024071439-A1 FUSED RING COMPOUND AND PHARMACEUTICAL CONTAINING SAME 科研製薬株式会社 2024-04-04 WO disclosed
US-20170313650-A1 SYNTHETIC BUILDING BLOCKS FOR THE PRODUCTION OF MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES UDC IRELAND LIMITED (IE) 2017-11-02 US disclosed
US-9718764-B2 Synthetic building blocks for the production of materials for organic electroluminescence devices MERCK PATENT GMBH (DE) 2017-08-01 US disclosed
US-20160046563-A1 SYNTHETIC BUILDING BLOCKS FOR THE PRODUCTION OF MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES UDC IRELAND LIMITED (IE) 2016-02-18 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-20160046563-A1 SYNTHETIC BUILDING BLOCKS FOR THE PRODUCTION OF MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES TBCB, CYBA, BMP2 KDM4E 2761/4885ALDH1A1 2033/4885SMN1; SMN2 4493/4885
US-20170313650-A1 SYNTHETIC BUILDING BLOCKS FOR THE PRODUCTION OF MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES TBCB, CYBA, BMP2 KDM4E 2761/4885ALDH1A1 2033/4885SMN1; SMN2 4493/4885

“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.