SCHEMBL23212291

SCHEMBL23212291

CCC[C@H](O)c1nc2ccc(Cl)cc2c(=O)n1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
TP53 P04637 1/20 0.43
KDM4E B2RXH2 2/20 0.42
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CACNA2D1 P54289 1/20 0.42
RXFP1 Q9HBX9 1/20 0.40
MAPT P10636 1/20 0.40
MAPK1 P28482 1/20 0.40
HDAC3 O15379 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC10 Q969S8 1/20 0.39
HDAC11 Q96DB2 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39

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
SCHEMBL23212293 1.00 KMT2A (0.43) KMT2AMEN1TP53KDM4ELMNA
SCHEMBL3823391 0.80 MEN1 (0.47) KMT2AMEN1KDM4ELMNAHTT
SCHEMBL24173162 0.74 CACNA2D1 (0.64) CACNA2D1
SCHEMBL15457139 0.74 KDM4E (0.50) KMT2AMEN1KDM4ELMNAHTT
SCHEMBL23212406 0.74 CACNA2D1 (0.51) CACNA2D1
SCHEMBL23212831 0.74 CACNA2D1 (0.51) CACNA2D1
SCHEMBL23212404 0.74 CACNA2D1 (0.51) CACNA2D1
SCHEMBL23212833 0.74 CACNA2D1 (0.51) CACNA2D1
SCHEMBL23212399 0.74 CACNA2D1 (0.51) CACNA2D1
SCHEMBL23212301 0.73 CACNA2D1 (0.57) CACNA2D1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12479830-B2 Homopiperazinyl and homopiperidinyl quinazolin-4(3H)-one derivatives having multimodal activity against pain ESTEVE PHARMACEUTICALS, S.A. (ES) 2025-11-25 US disclosed
CN-114502549-B Homopiperazinyl and homopiperidinyl quinazolin-4 (3H) -one derivatives having multimodal activity against pain 埃斯特韦制药股份公司 2024-10-25 CN disclosed
US-20220380345-A1 HOMOPIPERAZINYL AND HOMOPIPERIDINYL QUINAZOLIN-4(3H)-ONE DERIVATIVES HAVING MULTIMODAL ACTIVITY AGAINST PAIN ESTEVE PHARMACEUTICALS, S.A. (ES) 2022-12-01 US disclosed
EP-4041391-A1 HOMOPIPERAZINYL AND HOMOPIPERIDINYL QUINAZOLIN-4(3H)-ONE DERIVATIVES HAVING MULTIMODAL ACTIVITY AGAINST PAIN ESTEVE PHARMACEUTICALS, S.A. (ES) 2022-08-17 EP disclosed
CN-114502549-A Homopiperazinyl and homopiperidinyl quinazolin-4 (3H) -one derivatives having multimodal activity against pain 埃斯特韦制药股份公司 2022-05-13 CN disclosed
US-20220002314-A1 PIPERAZINYL AND PIPERIDINYL QUINAZOLIN-4(3H)-ONE DERIVATIVES HAVING ACTIVITY AGAINST PAIN ACONDICIONAMIENTO TARRASENSE (ES) 2022-01-06 US disclosed
CN-113260614-A Piperazinyl and piperidinyl quinazolin-4 (3H) -one derivatives active against pain 塔拉森斯调节公司 2021-08-13 CN disclosed
WO-2021069339-A1 HOMOPIPERAZINYL AND HOMOPIPERIDINYL QUINAZOLIN-4(3H)-ONE DERIVATIVES HAVING MULTIMODAL ACTIVITY AGAINST PAIN ESTEVE PHARMACEUTICALS, S.A. (ES) 2021-04-15 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 (3 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-12479830-B2 Homopiperazinyl and homopiperidinyl quinazolin-4(3H)-one derivatives having multimodal activity against pain OPRD1, SIGMAR1, OPRK1 KMT2A 4116/4885MEN1 4434/4885TP53 4770/4885
US-20220380345-A1 HOMOPIPERAZINYL AND HOMOPIPERIDINYL QUINAZOLIN-4(3H)-ONE DERIVATIVES HAVING MULTIMODAL ACTIVITY AGAINST PAIN OPRD1, SIGMAR1, OPRK1 KMT2A 4116/4885MEN1 4434/4885TP53 4770/4885
US-20220002314-A1 PIPERAZINYL AND PIPERIDINYL QUINAZOLIN-4(3H)-ONE DERIVATIVES HAVING ACTIVITY AGAINST PAIN OPRD1, TRPV1, OPRK1 KMT2A 2036/4885MEN1 4856/4885TP53 4814/4885

“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.