SCHEMBL5740638

SCHEMBL5740638

O=C1COCCN1c1cccnc1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 8/20 0.48
▸ DRD2 P14416 1/20 0.46
▸ DRD3 P35462 1/20 0.46
▸ CYP11B2 P19099 2/20 0.46
▸ HDAC1 Q13547 1/20 0.43
▸ F10 P00742 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ RECQL P46063 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ PIK3R1 P27986 1/20 0.42
▸ PIK3CA P42336 1/20 0.42
▸ MTOR P42345 1/20 0.42
▸ CYP11B1 P15538 1/20 0.42
▸ CA1 P00915 1/20 0.42
▸ CA2 P00918 1/20 0.42
▸ CA4 P22748 1/20 0.42
▸ CA7 P43166 1/20 0.42

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
SCHEMBL29865430 0.80 PTGS2 (0.52) PTGS2DRD2F10PIK3CAMTOR
SCHEMBL30227277 0.80 PTGS2 (0.46) PTGS2CYP11B2F10PIK3CA
SCHEMBL198132 0.80 PTGS2 (0.57) PTGS2F10
SCHEMBL22797004 0.78 CYP11B2 (0.54) DRD2DRD3CYP11B2HDAC1ALDH1A1
SCHEMBL30253230 0.78 PIK3CD (0.47) PTGS2CYP11B2PIK3CAMTOR
SCHEMBL15713710 0.78 CYP11B2 (0.48) DRD2DRD3CYP11B2HDAC1ALDH1A1
SCHEMBL8285973 0.77 PTGS2 (0.48) PTGS2DRD3F10MTOR
SCHEMBL6068510 0.76 CYP11B2 (0.47) DRD2DRD3CYP11B2HDAC1ALDH1A1
SCHEMBL31700253 0.76 GAA (0.58) DRD2DRD3CYP11B2HDAC1ALDH1A1
SCHEMBL306879 0.76 GAA (0.58) DRD2DRD3CYP11B2HDAC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250320213-A1 Nitrogen-Containing Heterocyclic Compounds PFIZER INC. (US) 2025-10-16 — — US disclosed
CN-115003663-A Novel heteroaryl-triazole compounds as pesticides 拜耳公司 2022-09-02 — — CN disclosed
US-11407721-B2 CIS-morpholinone and other compounds as MDM2 inhibitors for the treatment of cancer AMGEN INC. (US) 2022-08-09 — — US disclosed
EP-1697353-A2 ARALKYL AND ARALKYLIDENE HETEROCYCLIC LACTAMS WITH AFFINITY FOR 5-HT1 RECEPTORS Pfizer Products Incorporated (US) 2006-09-06 — — EP disclosed
US-20050227980-A1 Aralkyl and aralkylidene heterocyclic lactam and imides PFIZER INC. 2005-10-13 — — US disclosed
US-20050227981-A1 Aralkyl and aralkylidene heterocyclic lactam and imides PFIZER INC 2005-10-13 — — US disclosed
WO-2005061491-A2 ARALKYL AND ARALKYLIDENE HETEROCYCLIC LACTAMS WITH AFFINITY FOR 5-HT1 RECEPTORS PFIZER PRODUCTS INC. (US) 2005-07-07 — — 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 (4 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-20250320213-A1 Nitrogen-Containing Heterocyclic Compounds HRH4, HNMT, NNT PTGS2 269/4885DRD2 3450/4885DRD3 1931/4885
US-20050227981-A1 Aralkyl and aralkylidene heterocyclic lactam and imides ARAF, MRPL21, ACSL3 PTGS2 2236/4885DRD2 166/4885DRD3 89/4885
US-11407721-B2 CIS-morpholinone and other compounds as MDM2 inhibitors for the treatment of cancer MDM2, TP53, MDM4 PTGS2 2146/4885DRD2 4865/4885DRD3 4873/4885
US-20050227980-A1 Aralkyl and aralkylidene heterocyclic lactam and imides ARAF, MRPL21, ACSL3 PTGS2 2236/4885DRD2 166/4885DRD3 89/4885

“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.

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