SCHEMBL22014835

SCHEMBL22014835

NCCS(=O)(=O)C(F)C(=O)N1C[C@@H]2CN(c3ccc(Br)cc3)C[C@@H]2C1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EIF4H Q15056 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.34
LMNA P02545 2/20 0.34
MEN1 O00255 1/20 0.34
RECQL P46063 1/20 0.34
KMT2A Q03164 1/20 0.34
CA1 P00915 3/20 0.34
CA2 P00918 3/20 0.34
CA7 P43166 3/20 0.34
POLB P06746 3/20 0.33
MAPT P10636 2/20 0.33
TSHR P16473 1/20 0.33
AKR1C3 P42330 1/20 0.32
CHRM1 P11229 2/20 0.32
DPP4 P27487 1/20 0.32
CA12 O43570 2/20 0.32
CA9 Q16790 2/20 0.32
CA14 Q9ULX7 1/20 0.32
TP53 P04637 1/20 0.31
LSS P48449 1/20 0.31

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
SCHEMBL22014824 0.90 CHRM1 (0.36) EIF4HSMN1; SMN2LMNAMEN1KMT2A
SCHEMBL24209125 0.86 SMN1; SMN2 (0.34) EIF4HSMN1; SMN2LMNAMEN1RECQL
SCHEMBL22015315 0.79
SCHEMBL22014825 0.78 SMN1; SMN2 (0.38) EIF4HSMN1; SMN2LMNAMEN1RECQL
SCHEMBL24209303 0.77 CYP1A2 (0.39) SMN1; SMN2LMNAMEN1RECQLKMT2A
SCHEMBL24209174 0.75 SMN1; SMN2 (0.38) SMN1; SMN2LMNAMEN1RECQLKMT2A
SCHEMBL23701365 0.70 AKR1C3 (0.44) KMT2APOLBMAPTTSHRAKR1C3
SCHEMBL22804923 0.70 AKR1C3 (0.44) KMT2APOLBMAPTTSHRAKR1C3
SCHEMBL22014833 0.68 RAB9A (0.40) EIF4HSMN1; SMN2LMNAMEN1KMT2A
SCHEMBL22014828 0.68 GAA (0.40) SMN1; SMN2LMNAMEN1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220017516-A1 LOX INHIBITORS THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2022-01-20 US disclosed
WO-2020099886-A1 LOX INHIBITORS THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2020-05-22 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 (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-20220017516-A1 LOX INHIBITORS LOXL1, LOX, LOXL2 EIF4H 4628/4885SMN1; SMN2 3271/4885LMNA 455/4885

“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.