SCHEMBL20138341

SCHEMBL20138341

O=C(C1CCCCC1)N1CC[CH]CC1

nearest known ligand 0.72

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.72
TSHR P16473 2/20 0.72
HPGD P15428 1/20 0.59
HSD11B1 P28845 8/20 0.55
LMNA P02545 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.53
HSD11B2 P80365 2/20 0.50
KMT2A Q03164 1/20 0.50
CNR1 P21554 1/20 0.49
CNR2 P34972 1/20 0.49
PTPN1 P18031 1/20 0.47
KEAP1 Q14145 1/20 0.47

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
SCHEMBL4696278 0.98 ALDH1A1 (0.68) ALDH1A1TSHRHPGDHSD11B1LMNA
SCHEMBL28468465 0.94 ALDH1A1 (0.61) ALDH1A1TSHRHPGDHSD11B1LMNA
SCHEMBL1276137 0.89 HPGD (0.60) ALDH1A1TSHRHPGDHSD11B1LMNA
SCHEMBL28763508 0.88 ALDH1A1 (0.61) ALDH1A1TSHRHPGDHSD11B1LMNA
SCHEMBL18228463 0.86 HPGD (0.63) ALDH1A1TSHRHPGDHSD11B1LMNA
SCHEMBL7131881 0.84 ALDH1A1 (1.00) ALDH1A1TSHRHPGDHSD11B1LMNA
SCHEMBL10559542 0.84 ALDH1A1 (1.00) ALDH1A1TSHRHPGDHSD11B1LMNA
SCHEMBL1309352 0.82 ALDH1A1 (0.86) ALDH1A1TSHRHPGDHSD11B1LMNA
SCHEMBL2386976 0.82 ALDH1A1 (0.86) ALDH1A1TSHRHPGDHSD11B1LMNA
SCHEMBL1826063 0.82 ALDH1A1 (0.86) ALDH1A1TSHRHPGDHSD11B1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112370452-A Heterocyclic amides as kinase inhibitors 葛兰素史密斯克莱知识产权发展有限公司 2021-02-19 CN disclosed
CN-107624111-B Heterocyclic amides as kinase inhibitors 葛兰素史密斯克莱知识产权发展有限公司 2020-11-03 CN disclosed
US-10590085-B2 Heterocyclic amides as kinase inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-03-17 US disclosed
US-20180134665-A1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2018-05-17 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 (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-10590085-B2 Heterocyclic amides as kinase inhibitors MAP3K19, MAP3K20, MAP3K1 ALDH1A1 1542/4885TSHR 843/4885HPGD 2029/4885
US-20180134665-A1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS MAP3K19, MAP3K20, MAP3K1 ALDH1A1 1542/4885TSHR 843/4885HPGD 2029/4885

“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.