SCHEMBL722270

SCHEMBL722270

COC(=O)c1ccc(NCC2CC2)cc1Cl

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 2/20 0.52
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
EGFR P00533 1/20 0.40
CRHR1 P34998 5/20 0.40
ABL1 P00519 1/20 0.40
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CNR2 P34972 2/20 0.40
GCK P35557 1/20 0.39
ACHE P22303 1/20 0.39
BACE1 P56817 1/20 0.39
GAA P10253 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
SCHEMBL14214714 0.81 AVPR2 (0.47) MEN1KMT2ANPC1RAB9AEGFR
SCHEMBL18930912 0.78 AVPR2 (0.49) MEN1KMT2AEGFRABL1LMNA
SCHEMBL252636 0.77 KMT2A (0.55) PTGER4MEN1KMT2ARAB9AEGFR
SCHEMBL20073958 0.76 MAPT (0.41) MEN1KMT2AEGFRABL1LMNA
SCHEMBL2341546 0.76 ABL1 (0.49) MEN1KMT2ANPC1RAB9AABL1
SCHEMBL1856929 0.75 PARP10 (0.50)
SCHEMBL2342749 0.75 ABL1 (0.45) MEN1KMT2ANPC1RAB9AABL1
SCHEMBL14185026 0.75 RAF1 (0.45) MEN1KMT2ANPC1RAB9AABL1
SCHEMBL4157373 0.74 MAPT (0.53) MEN1KMT2ANPC1RAB9AABL1
SCHEMBL24072702 0.74 PTGER4 (0.51) PTGER4MEN1KMT2ANPC1RAB9A

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
US-8754100-B2 Nitrogen-containing fused heterocyclic compounds and their use as beta amyloid production inhibitors EISAI R&D MANAGEMENT CO., LTD. (JP) 2014-06-17 US disclosed
EP-2615090-A1 Nitrogen-containing fused heterocyclic compounds and their use as beta amyloid production inhibitors Eisai R&D Management Co., Ltd. (JP) 2013-07-17 EP disclosed
EP-2401276-B1 NITROGEN-CONTAINING FUSED HETEROCYCLIC COMPOUNDS AND THEIR USE AS BETA AMYLOID PRODUCTION INHIBITORS EISAI R&D MAN CO LTD (JP) 2013-06-05 EP disclosed
US-20120053171-A1 Nitrogen-Containing Fused Heterocyclic Compounds and Their use as Beta Amyloid Production Inhibitors EISAI R&D MANAGEMENT CO., LTD., (JP) 2012-03-01 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 (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-20120053171-A1 Nitrogen-Containing Fused Heterocyclic Compounds and Their use as Beta Amyloid Production Inhibitors BACE1, APP, PSEN1 PTGER4 4034/4885MEN1 387/4885KMT2A 3881/4885

“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.