SCHEMBL20013751

SCHEMBL20013751

O=C(O)C1C(C(=O)Nc2cccc(Cl)c2)C2C=CC1C21CC1

nearest known ligand 0.73

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.73
SMN1; SMN2 Q16637 3/20 0.73
MEN1 O00255 3/20 0.64
KMT2A Q03164 3/20 0.64
FPR2 P25090 9/20 0.62
PKM P14618 1/20 0.57
HTT P42858 4/20 0.53
LMNA P02545 3/20 0.53
MAPT P10636 3/20 0.53
NPSR1 Q6W5P4 1/20 0.53
KDM4E B2RXH2 2/20 0.51
HPGD P15428 1/20 0.51
FPR3 P25089 3/20 0.48
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
GAA P10253 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL727476 0.85 FPR2 (0.77) ALDH1A1SMN1; SMN2MEN1KMT2AFPR2
SCHEMBL20009932 0.85 PKM (0.63) ALDH1A1SMN1; SMN2MEN1KMT2AFPR2
SCHEMBL20013750 0.84 ALDH1A1 (1.00) ALDH1A1SMN1; SMN2FPR2PKMLMNA
SCHEMBL728702 0.84 ALDH1A1 (0.74) ALDH1A1SMN1; SMN2FPR2PKMFPR3
SCHEMBL21310365 0.82 HTT (0.62) ALDH1A1SMN1; SMN2MEN1KMT2AFPR2
SCHEMBL726965 0.82 FPR2 (0.58) ALDH1A1SMN1; SMN2MEN1KMT2AFPR2
SCHEMBL20013749 0.78 MEN1 (1.00) ALDH1A1SMN1; SMN2MEN1KMT2APKM
SCHEMBL728698 0.78 FPR2 (0.74) ALDH1A1SMN1; SMN2FPR2PKMFPR3
SCHEMBL726966 0.78 FPR2 (0.78) ALDH1A1SMN1; SMN2MEN1KMT2AFPR2
SCHEMBL726819 0.76 FPR2 (1.00) ALDH1A1SMN1; SMN2FPR2PKMFPR3

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
EP-3897609-B1 METHODS OF TREATMENT AND DIAGNOSIS OF TUMOURS UEA ENTERPRISES LTD (GB) 2024-01-24 EP disclosed
WO-2023209077-A1 BRIDGED BICYCLIC CARBOXYLIC ACIDS FOR TREATING OSTEOSARCOMA AND EWING SARCOMA UEA ENTERPRISES LIMITED (GB) 2023-11-02 WO disclosed
WO-2020128534-A1 METHODS OF TREATMENT AND DIAGNOSIS OF TUMOURS UEA ENTERPRISES LIMITED (GB) 2020-06-25 WO disclosed
US-10329246-B2 RUNX2 transcription factor inhibitors and uses thereof UNIVERSITY OF MARYLAND, BALTIMORE (US) 2019-06-25 US disclosed
US-20180086696-A1 RUNX2 Transcription Factor Inhibitors and Uses Thereof UNIVERSITY OF MARYLAND, BALTIMORE (US) 2018-03-29 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-20180086696-A1 RUNX2 Transcription Factor Inhibitors and Uses Thereof CBFB, RUNX1, NCOA3 ALDH1A1 4181/4885SMN1; SMN2 3505/4885MEN1 1664/4885
US-10329246-B2 RUNX2 transcription factor inhibitors and uses thereof CBFB, RUNX1, NCOA3 ALDH1A1 4181/4885SMN1; SMN2 3505/4885MEN1 1664/4885

“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.