SCHEMBL2168963

SCHEMBL2168963

CC1(C)C(=O)N(C2C3CC4CC(C3)CC2C4)N1C(=O)c1cccc(Br)c1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
TP53 P04637 1/20 0.43
HPGD P15428 1/20 0.41
L3MBTL3 Q96JM7 5/20 0.41
L3MBTL1 Q9Y468 3/20 0.41
KMT5A Q9NQR1 1/20 0.39
TSHR P16473 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
L3MBTL4 Q8NA19 1/20 0.38
BCHE P06276 1/20 0.38
SLC6A3 Q01959 1/20 0.38
GAA P10253 1/20 0.38
USP2 O75604 1/20 0.38
MBTD1 Q05BQ5 2/20 0.37
KMT2A Q03164 1/20 0.37
PLAU P00749 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36

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
SCHEMBL2169041 0.87 HPGD (0.41) ALDH1A1HPGDL3MBTL1BCHEUSP2
SCHEMBL13368833 0.87 USP2 (0.38) USP2
SCHEMBL2168658 0.86 PLA2G7 (0.41) ALDH1A1HPGDL3MBTL1TSHRUSP2
SCHEMBL2169563 0.86 P2RX7 (0.40) ALDH1A1TP53NPSR1USP2KMT2A
SCHEMBL2170348 0.86 USP2 (0.38) HPGDL3MBTL3L3MBTL1BCHEGAA
SCHEMBL2169090 0.86 USP2 (0.51) ALDH1A1TSHRUSP2KMT2A
SCHEMBL2168721 0.84 KMT2A (0.46) ALDH1A1HPGDL3MBTL1BCHEKMT2A
SCHEMBL2169592 0.84 ALDH1A1 (0.47) ALDH1A1TP53L3MBTL1TSHRKMT2A
SCHEMBL2185159 0.84 LMNA (0.44) ALDH1A1TP53HPGDNPSR1KMT2A
SCHEMBL2170502 0.82 RAB9A (0.43) HPGDTSHRBCHEUSP2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8252781-B2 1,2-diazetidin-3-one derivatives and drugs containing same KOWA COMPANY, LTD. (JP) 2012-08-28 US claimed
EP-2348019-A1 1,2-DIAZETIDIN-3-ONE DERIVATIVE AND PHARMACEUTICAL AGENT COMPRISING SAME Kowa Company, Ltd. (JP) 2011-07-27 EP claimed
US-20100144694-A1 1,2-DIAZETIDIN-3-ONE DERIVATIVES AND DRUGS CONTAINING SAME KOWA COMPANY, LTD. (JP) 2010-06-10 US claimed
US-8252781-B2 1,2-diazetidin-3-one derivatives and drugs containing same KOWA COMPANY, LTD. (JP) 2012-08-28 US disclosed
US-8252781-B2 1,2-diazetidin-3-one derivatives and drugs containing same KOWA COMPANY, LTD. (JP) 2012-08-28 US disclosed
US-8252781-B2 1,2-diazetidin-3-one derivatives and drugs containing same KOWA COMPANY, LTD. (JP) 2012-08-28 US disclosed
EP-2348019-A1 1,2-DIAZETIDIN-3-ONE DERIVATIVE AND PHARMACEUTICAL AGENT COMPRISING SAME Kowa Company, Ltd. (JP) 2011-07-27 EP disclosed
US-20100144694-A1 1,2-DIAZETIDIN-3-ONE DERIVATIVES AND DRUGS CONTAINING SAME KOWA COMPANY, LTD. (JP) 2010-06-10 US disclosed
US-20100144694-A1 1,2-DIAZETIDIN-3-ONE DERIVATIVES AND DRUGS CONTAINING SAME KOWA COMPANY, LTD. (JP) 2010-06-10 US disclosed
US-20100144694-A1 1,2-DIAZETIDIN-3-ONE DERIVATIVES AND DRUGS CONTAINING SAME KOWA COMPANY, LTD. (JP) 2010-06-10 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-20100144694-A1 1,2-DIAZETIDIN-3-ONE DERIVATIVES AND DRUGS CONTAINING SAME HSD11B1, HSD11B2, HSD3B1 ALDH1A1 157/4885TP53 4290/4885HPGD 101/4885

“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.