SCHEMBL2993890

SCHEMBL2993890

Nc1ccc(C(=O)N2CCC(O)C2)cc1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.55
HDAC4 P56524 1/20 0.51
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA7 P43166 1/20 0.50
CA9 Q16790 1/20 0.50
CA14 Q9ULX7 1/20 0.50
GRM5 P41594 1/20 0.50
L3MBTL3 Q96JM7 5/20 0.49
L3MBTL1 Q9Y468 3/20 0.49
PDK2 Q15119 1/20 0.48
GRM3 Q14832 2/20 0.48
ATR Q13535 1/20 0.47
MBTD1 Q05BQ5 1/20 0.46
TP53BP1 Q12888 1/20 0.46
L3MBTL4 Q8NA19 1/20 0.46

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
SCHEMBL19144451 1.00 MGLL (0.55) MGLLHDAC4CA12CA1CA2
SCHEMBL2998896 0.90 GRM3 (0.59) MGLLCA12CA1CA2CA7
SCHEMBL3001302 0.90 MGLL (0.61) MGLLCA12CA1CA2CA7
SCHEMBL2993886 0.87 HDAC4 (0.54) HDAC4GRM5L3MBTL3L3MBTL1PDK2
SCHEMBL7903359 0.86 CA12 (0.51) MGLLCA12CA1CA2CA7
SCHEMBL24185208 0.83 MGLL (0.55) MGLLCA12CA1CA2CA7
SCHEMBL2825708 0.83 NPC1 (0.62) MGLLHDAC4L3MBTL1
SCHEMBL10195732 0.83 KMT2A (0.62) MGLLHDAC4GRM5L3MBTL3GRM3
SCHEMBL21590166 0.83 L3MBTL3 (0.59) MGLLHDAC4CA12CA1CA2
SCHEMBL19967770 0.83 MGLL (0.62) MGLL

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
US-20100190773-A1 Anti-Cytokine Heterocyclic Compounds BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-07-29 US claimed
US-20060276496-A1 Anti-Cytokine Heterocyclic Compounds BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2006-12-07 US claimed
EP-4711369-A1 1H-[1,2,3]TRIAZOLO[4,5-H]QUINAZOLINE COMPOUNDS AS PROTEIN KINASE INHIBITORS Chengdu Cynogen Bio-Pharmaceutical Technology Co., Ltd. (CN) 2026-03-18 EP disclosed
WO-2024245406-A1 1H-[1,2,3]TRIAZOLO[4,5-H]QUINAZOLINE COMPOUNDS AS PROTEIN KINASE INHIBITORS 成都赛璟生物医药科技有限公司 2024-12-05 WO disclosed
WO-2020224568-A1 CDK INHIBITORS QILU REGOR THERAPEUTICS INC. (CN) 2020-11-12 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 (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-20060276496-A1 Anti-Cytokine Heterocyclic Compounds MAPKAPK2, MAP4K2, MAP3K2 MGLL 4502/4885HDAC4 783/4885CA12 3780/4885
US-20100190773-A1 Anti-Cytokine Heterocyclic Compounds MAPKAPK2, MAP4K2, MAP3K2 MGLL 4502/4885HDAC4 783/4885CA12 3780/4885

“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.