SCHEMBL24035799

SCHEMBL24035799

O=C(NCc1nc(-c2cc3c(NC4CCOCC4)cccc3n2CC(F)(F)F)no1)C1CC1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 4/20 0.37
HTR1A P08908 7/20 0.37
DRD2 P14416 7/20 0.37
DRD4 P21917 7/20 0.37
KCNH2 Q12809 3/20 0.37
CNR2 P34972 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
HDAC5 Q9UQL6 1/20 0.35
CYP2C9 P11712 1/20 0.34
EPHX2 P34913 1/20 0.34
CREBBP Q92793 1/20 0.34
METAP2 P50579 1/20 0.34

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
SCHEMBL24036446 0.91 EPHX2 (0.39) HDAC1HDAC8HDAC6HDAC5CYP2C9
SCHEMBL24852991 0.91 CCR2 (0.36) HDAC1HDAC8HDAC6HDAC5CYP2C9
SCHEMBL24035292 0.91 CNR1 (0.36) CNR1HDAC1HDAC8HDAC6HDAC5
SCHEMBL24036025 0.89 NSD2 (0.38) HDAC8HDAC6CYP2C9EPHX2
SCHEMBL24035169 0.89 EPHX2 (0.38) HTR1ADRD2DRD4KCNH2HDAC1
SCHEMBL24035291 0.89 HDAC4 (0.34) HDAC1HDAC8HDAC6HDAC5EPHX2
SCHEMBL30177456 0.89 HDAC4 (0.34) HDAC1HDAC8HDAC6HDAC5EPHX2
SCHEMBL24035161 0.88 HDAC6 (0.36) CNR1HDAC1HDAC8HDAC6HDAC5
SCHEMBL30177485 0.88 HDAC6 (0.36) CNR1HDAC1HDAC8HDAC6HDAC5
SCHEMBL24035168 0.88 KCNH2 (0.41) KCNH2HDAC5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11938124-B2 Combination therapy for treatment of cancer PMV PHARMACEUTICALS, INC. (US) 2024-03-26 US disclosed
US-20240043436-A1 METHODS AND COMPOUNDS FOR RESTORING MUTANT p53 FUNCTION PMV PHARMACEUTICALS, INC. 2024-02-08 US disclosed
US-11807644-B2 Methods and compounds for restoring mutant p53 function PMV PHARMACEUTICALS, INC. (US) 2023-11-07 US disclosed
US-11807644-B2 Methods and compounds for restoring mutant p53 function PMV PHARMACEUTICALS, INC. (US) 2023-11-07 US disclosed
US-11807644-B2 Methods and compounds for restoring mutant p53 function PMV PHARMACEUTICALS, INC. (US) 2023-11-07 US disclosed
EP-4149459-A1 METHODS AND COMPOUNDS FOR RESTORING MUTANT P53 FUNCTION PMV Pharmaceuticals, Inc. (US) 2023-03-22 EP disclosed
US-20230049952-A1 METHODS AND COMPOUNDS FOR RESTORING MUTANT P53 FUNCTION PMV PHARMACEUTICALS, INC. 2023-02-16 US disclosed
US-20230044826-A1 COMPANION DIAGNOSTIC TOOL FOR MUTANT P53 REACTIVATING COMPOUNDS PMV PHARMACEUTICALS, INC. 2023-02-09 US disclosed
US-20230033324-A1 COMBINATION THERAPY FOR TREATMENT OF CANCER PMV PHARMACEUTICALS, INC. 2023-02-02 US disclosed
US-20230024905-A1 USES OF P53 X-RAY CO-CRYSTAL STRUCTURES PMV PHARMACEUTICALS, INC. 2023-01-26 US disclosed
US-20230002403-A1 METHODS AND COMPOUNDS FOR RESTORING MUTANT p53 FUNCTION PMV PHARMACEUTICALS, INC. 2023-01-05 US disclosed
US-20230002403-A1 METHODS AND COMPOUNDS FOR RESTORING MUTANT p53 FUNCTION PMV PHARMACEUTICALS, INC. 2023-01-05 US disclosed
WO-2021231474-A1 METHODS AND COMPOUNDS FOR RESTORING MUTANT p53 FUNCTION PMV PHARMACEUTICALS, INC. (US) 2021-11-18 WO disclosed
WO-2021231474-A1 METHODS AND COMPOUNDS FOR RESTORING MUTANT p53 FUNCTION PMV PHARMACEUTICALS, INC. (US) 2021-11-18 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 (8 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-11938124-B2 Combination therapy for treatment of cancer TP53, KRAS, TP53BP1 CNR1 4545/4885HTR1A 4662/4885DRD2 4711/4885
US-20230002403-A1 METHODS AND COMPOUNDS FOR RESTORING MUTANT p53 FUNCTION TP53, TP53BP1, HRAS CNR1 4652/4885HTR1A 4470/4885DRD2 4573/4885
US-20230049952-A1 METHODS AND COMPOUNDS FOR RESTORING MUTANT P53 FUNCTION TP53, TP53BP1, KRAS CNR1 4539/4885HTR1A 4585/4885DRD2 4653/4885
US-20230033324-A1 COMBINATION THERAPY FOR TREATMENT OF CANCER TP53, KRAS, TP53BP1 CNR1 4545/4885HTR1A 4662/4885DRD2 4711/4885
US-20230044826-A1 COMPANION DIAGNOSTIC TOOL FOR MUTANT P53 REACTIVATING COMPOUNDS TP53, TP53BP1, KRAS CNR1 4581/4885HTR1A 4304/4885DRD2 4406/4885
US-11807644-B2 Methods and compounds for restoring mutant p53 function TP53, TP53BP1, HRAS CNR1 4652/4885HTR1A 4470/4885DRD2 4573/4885
US-20240043436-A1 METHODS AND COMPOUNDS FOR RESTORING MUTANT p53 FUNCTION TP53, TP53BP1, HRAS CNR1 4652/4885HTR1A 4470/4885DRD2 4573/4885
US-20230024905-A1 USES OF P53 X-RAY CO-CRYSTAL STRUCTURES TP53, TP53BP1, MDM2 CNR1 4674/4885HTR1A 4601/4885DRD2 4796/4885

“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.