SCHEMBL20568540

SCHEMBL20568540

CNC(=O)c1cc(Cl)c(C#N)cn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 7/20 0.47
▸ LRRK2 Q5S007 2/20 0.45
▸ ADORA1 P30542 3/20 0.41
▸ GRM4 Q14833 1/20 0.41
▸ CNR2 P34972 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ APEX1 P27695 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ THPO P40225 1/20 0.40

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
SCHEMBL30692943 1.00 AR (0.47) ARLRRK2ADORA1GRM4CNR2
SCHEMBL20568366 0.80 LRRK2 (0.41) LRRK2GRM4KDM4EALDH1A1S1PR3
SCHEMBL19249055 0.79 BAZ2B (0.42) ARLRRK2ADORA1KDM4ENPC1
SCHEMBL24959995 0.76 NPC1 (0.42) CNR2KDM4ENPC1ALDH1A1LMNA
SCHEMBL31224325 0.76 NPC1 (0.42) CNR2KDM4ENPC1ALDH1A1LMNA
SCHEMBL27106855 0.74 AKR1B1 (0.48) CNR2CYP1A2CYP2C9HPGDCYP2C19
SCHEMBL24960104 0.74 MAPT (0.41) CNR2KDM4ENPC1ALDH1A1LMNA
SCHEMBL31224184 0.73 ALDH1A1 (0.49) LRRK2GRM4CNR2KDM4ENPC1
SCHEMBL14804259 0.72 AR (0.51) ARLRRK2CYP1A2CYP3A4CYP2C9
SCHEMBL20861501 0.72 PTK2 (0.49) ARALDH1A1MAPK8MAPK9S1PR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3630749-B9 2-QUINOLONE DERIVED INHIBITORS OF BCL6 CANCER RESEARCH TECH LTD (GB) 2024-05-29 — — EP disclosed
EP-4371562-A2 2-QUINOLONE DERIVED INHIBITORS OF BCL6 Cancer Research Technology Limited (GB) 2024-05-22 — — EP disclosed
EP-3630749-B1 2-QUINOLONE DERIVED INHIBITORS OF BCL6 CANCER RESEARCH TECH LTD (GB) 2024-01-10 — — EP disclosed
US-11161839-B2 2-quinolone derived inhibitors of BCL6 THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2021-11-02 — — US disclosed
US-11161839-B2 2-quinolone derived inhibitors of BCL6 THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2021-11-02 — — US disclosed
US-20210206756-A1 2-QUINOLONE DERIVED INHIBITORS OF BCL6 THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2021-07-08 — — US disclosed
US-20210206756-A1 2-QUINOLONE DERIVED INHIBITORS OF BCL6 THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2021-07-08 — — US disclosed
EP-3630749-A1 2-QUINOLONE DERIVED INHIBITORS OF BCL6 Cancer Research Technology Limited (GB) 2020-04-08 — — EP disclosed
WO-2018215798-A1 2-QUINOLONE DERIVED INHIBITORS OF BCL6 CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2018-11-29 — — 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-11161839-B2 2-quinolone derived inhibitors of BCL6 BCL6, BCL6B, BCL3 AR 1725/4885LRRK2 1760/4885ADORA1 4455/4885
US-20210206756-A1 2-QUINOLONE DERIVED INHIBITORS OF BCL6 BCL6, BCL6B, BCL3 AR 1725/4885LRRK2 1760/4885ADORA1 4455/4885

“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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