SCHEMBL10067944

SCHEMBL10067944

CCC(=O)C1CCCNC1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A1 P30531 4/20 0.59
SLC6A11 P48066 3/20 0.59
SLC6A13 Q9NSD5 3/20 0.59
TSHR P16473 1/20 0.59
LMNA P02545 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
KMT2A Q03164 2/20 0.57
KDM4E B2RXH2 1/20 0.57
MAPT P10636 1/20 0.57
ATM Q13315 1/20 0.57
CYP2D6 P10635 1/20 0.57
NOS2 P35228 1/20 0.47
CPN1 P15169 2/20 0.39
CPB2 Q96IY4 2/20 0.39
EPHX1 P07099 1/20 0.36
ALOX15 P16050 1/20 0.34
APLNR P35414 2/20 0.34
GABRA5 P31644 2/20 0.34
GABRB2 P47870 2/20 0.34
SLC6A12 P48065 2/20 0.34

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
SCHEMBL21341280 1.00 SLC6A1 (0.59) SLC6A1SLC6A11SLC6A13TSHRLMNA
SCHEMBL16856684 1.00 SLC6A1 (0.59) SLC6A1SLC6A11SLC6A13TSHRLMNA
SCHEMBL16359913 0.94 SLC6A1 (0.52) SLC6A1SLC6A11SLC6A13TSHRLMNA
SCHEMBL25015448 0.88
SCHEMBL14218506 0.88
SCHEMBL24073181 0.88
SCHEMBL7755255 0.82 SLC6A1 (0.61) SLC6A1SLC6A11SLC6A13TSHRLMNA
SCHEMBL17204414 0.81 SLC6A1 (0.55) SLC6A1SLC6A11SLC6A13TSHRLMNA
SCHEMBL2880053 0.80 SLC6A1 (0.50) SLC6A1SLC6A11SLC6A13TSHRLMNA
SCHEMBL3982090 0.80 SLC6A1 (0.59) SLC6A1SLC6A11SLC6A13TSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3255042-B1 HETEROCYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME BEYONDBIO INC (KR) 2020-12-30 EP disclosed
US-20200190062-A1 HETEROCYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME BEYONDBIO INC. (KR) 2020-06-18 US disclosed
US-10611754-B2 Heterocyclic compound and pharmaceutical composition comprising same BEYONDBIO INC. (KR) 2020-04-07 US disclosed
US-10336787-B2 Progesterone analogs and uses related thereto EMORY UNIVERSITY (US) 2019-07-02 US disclosed
US-20190192668-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2019-06-27 US disclosed
US-20190135786-A1 HETEROCYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME BEYONDBIO INC. (KR) 2019-05-09 US disclosed
US-10227328-B2 Heterocyclic compound and pharmaceutical composition comprising same BEYONDBIO INC. (KR) 2019-03-12 US disclosed
US-20180273510-A1 HETEROCYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME BEYONDBIO INC. (KR) 2018-09-27 US disclosed
US-9132133-B2 Nitrogen containing compounds WOCKHARDT LTD. (IN) 2015-09-15 US disclosed
US-20150174133-A1 NITROGEN CONTAINING COMPOUNDS WOCKHARDT LIMITED (IN) 2015-06-25 US disclosed
US-20120077711-A1 Novel Ligands and Libraries of Ligands SUNESIS PHARMACEUTICALS, INC. (US) 2012-03-29 US disclosed
CN-101679440-A Pyrrolopyrimidine derivatives as jak3 inhibitors PALAU PHARMA SA 2010-03-24 CN disclosed
US-20070112000-A1 Chemical compounds ASTRAZENECA R&D ALDERLEY (GB) 2007-05-17 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 (10 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-10336787-B2 Progesterone analogs and uses related thereto PGR, SHBG, PGRMC1 SLC6A1 1252/4885SLC6A11 1082/4885SLC6A13 1314/4885
US-20190135786-A1 HETEROCYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME CDK5, CDK1, CDK4 SLC6A1 3063/4885SLC6A11 2667/4885SLC6A13 3418/4885
US-20150174133-A1 NITROGEN CONTAINING COMPOUNDS NOS2, NOS1, NCF1 SLC6A1 1130/4885SLC6A11 1290/4885SLC6A13 1664/4885
US-20070112000-A1 Chemical compounds HSD11B1, CYP11B1, HSD11B2 SLC6A1 1965/4885SLC6A11 1311/4885SLC6A13 2637/4885
US-10227328-B2 Heterocyclic compound and pharmaceutical composition comprising same CDK5, CDK1, CDK4 SLC6A1 3063/4885SLC6A11 2667/4885SLC6A13 3418/4885
US-20200190062-A1 HETEROCYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME CDK5, CDK3, CDK1 SLC6A1 3201/4885SLC6A11 2856/4885SLC6A13 3483/4885
US-20180273510-A1 HETEROCYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME CDK5, CDK1, CDK4 SLC6A1 3063/4885SLC6A11 2667/4885SLC6A13 3418/4885
US-20190192668-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 SLC6A1 4851/4885SLC6A11 4850/4885SLC6A13 4853/4885
US-20120077711-A1 Novel Ligands and Libraries of Ligands LSS, ABCG2, SELL SLC6A1 1832/4885SLC6A11 1824/4885SLC6A13 2322/4885
US-10611754-B2 Heterocyclic compound and pharmaceutical composition comprising same CDK5, CDK1, CDK4 SLC6A1 3063/4885SLC6A11 2667/4885SLC6A13 3418/4885

“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.