SCHEMBL25311588

SCHEMBL25311588

O=C(NC1CCN(C(=O)c2cccc(-c3cn4ccccc4n3)c2)CC1)c1cccc(-c2cn3ccccc3n2)c1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.56
NPC1 O15118 3/20 0.56
KDM4E B2RXH2 9/20 0.56
SMN1; SMN2 Q16637 5/20 0.56
POLB P06746 3/20 0.56
LMNA P02545 2/20 0.56
GFER P55789 1/20 0.56
ALDH1A1 P00352 8/20 0.54
HPGD P15428 3/20 0.54
MAPT P10636 2/20 0.54
KMT2A Q03164 2/20 0.54
HPGDS O60760 4/20 0.52
MAPK1 P28482 1/20 0.48
TP53 P04637 1/20 0.48
ATM Q13315 1/20 0.47
GAA P10253 1/20 0.46
MEN1 O00255 1/20 0.46
EPHX1 P07099 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
SCHEMBL29484624 1.00 RAB9A (0.56) RAB9ANPC1KDM4ESMN1; SMN2POLB
SCHEMBL25311960 0.92 KDM4E (0.56) RAB9ANPC1KDM4ESMN1; SMN2POLB
SCHEMBL29466339 0.91 KDM4E (0.51) RAB9ANPC1KDM4ESMN1; SMN2POLB
SCHEMBL29466302 0.89 KDM4E (0.52) RAB9ANPC1KDM4ESMN1; SMN2POLB
SCHEMBL25312201 0.89 KDM4E (0.52) RAB9ANPC1KDM4ESMN1; SMN2POLB
SCHEMBL25878977 0.89 KDM4E (0.55) RAB9ANPC1KDM4ESMN1; SMN2POLB
SCHEMBL25878621 0.89 RAB9A (0.57) RAB9ANPC1KDM4ESMN1; SMN2POLB
SCHEMBL25878981 0.87 KDM4E (0.54) RAB9ANPC1KDM4ESMN1; SMN2POLB
SCHEMBL25310943 0.87 HPGDS (0.51) RAB9ANPC1KDM4ESMN1; SMN2POLB
SCHEMBL29484616 0.86 NAMPT (0.49) RAB9ANPC1KDM4ESMN1; SMN2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240101552-A1 CARBONYL HETEROCYCLIC COMPOUND AND APPLICATION THEREOF SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2024-03-28 US disclosed
EP-4215526-A1 CARBONYL HETEROCYCLIC COMPOUND AND APPLICATION THEREOF Shanghai Pharmaceuticals Holding Co., Ltd. (CN) 2023-07-26 EP disclosed
EP-4215526-A1 CARBONYL HETEROCYCLIC COMPOUND AND APPLICATION THEREOF Shanghai Pharmaceuticals Holding Co., Ltd. (CN) 2023-07-26 EP 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 (1 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-20240101552-A1 CARBONYL HETEROCYCLIC COMPOUND AND APPLICATION THEREOF LANCL2, CBS, LCP2 RAB9A 2591/4885NPC1 1564/4885KDM4E 2757/4885

“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.