SCHEMBL22014820

SCHEMBL22014820

CCOc1ccc(N2C[C@H]3CN(C(=O)CS(=O)(=O)CCN)C[C@H]3C2)cc1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACACB O00763 11/20 0.40
MAPT P10636 2/20 0.40
YAP1 P46937 1/20 0.39
TEAD4 Q15561 1/20 0.39
TEAD2 Q15562 1/20 0.39
FKBP1A P62942 1/20 0.39
PKM P14618 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL24209504 0.83 MAPT (0.43) ACACBMAPTYAP1TEAD4TEAD2
SCHEMBL22014825 0.83 SMN1; SMN2 (0.38) MAPTSMN1; SMN2
SCHEMBL22014827 0.83 KMT2A (0.46) MAPTSMN1; SMN2
SCHEMBL22014833 0.83 RAB9A (0.40) MAPTSMN1; SMN2
SCHEMBL22014801 0.82 HTR7 (0.43) ACACBMAPTPKMSMN1; SMN2
SCHEMBL24209212 0.82 MAPT (0.50) MAPTYAP1TEAD4TEAD2FKBP1A
SCHEMBL24209495 0.80 ALDH1A1 (0.35) ACACBMAPTYAP1TEAD4TEAD2
SCHEMBL24209170 0.80 ALDH1A1 (0.35) ACACBMAPTYAP1TEAD4TEAD2
SCHEMBL24209211 0.80 ALDH1A1 (0.35) ACACBMAPTYAP1TEAD4TEAD2
SCHEMBL22015282 0.80 ALDH1A1 (0.36) MAPTYAP1TEAD4TEAD2SMN1; SMN2

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 ACACB 818/4885MAPT 4629/4885YAP1 1547/4885

“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.