SCHEMBL22981913

SCHEMBL22981913

O=C(O)NC1(c2csc(Cl)n2)CCCNC1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ BAZ2A Q9UIF9 1/20 0.33
▸ SLC6A9 P48067 1/20 0.33
▸ HDAC1 Q13547 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ SIGMAR1 Q99720 2/20 0.31
▸ SSTR4 P31391 1/20 0.31
▸ TACR3 P29371 1/20 0.30

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
SCHEMBL22986378 0.88 SLC6A9 (0.36) BAZ2ASLC6A9HDAC1
Hydrochloric Acid SCHEMBL22981393 0.74 FPR2 (0.36) SLC6A9HSD17B10SIGMAR1
SCHEMBL4011286 0.74 SLC6A9 (0.50) SLC6A9HDAC1HSD17B10SIGMAR1SSTR4
SCHEMBL22981246 0.70 BRD4 (0.38) SLC6A9HSD17B10
SCHEMBL18920481 0.69 BPTF (0.32) BAZ2A
SCHEMBL15536568 0.68 MAP4K4 (0.38) —
SCHEMBL22490815 0.66 HDAC1 (0.35) HDAC1
SCHEMBL22986346 0.66 SLC6A9 (0.37) SLC6A9HSD17B10
Hydrochloric Acid SCHEMBL28751832 0.65 SLC6A9 (0.37) SLC6A9HSD17B10
SCHEMBL16515232 0.65 KDM4E (0.37) SLC6A9HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230002388-A1 PIPERIDINYL-METHYL-PURINEAMINES AS NSD2 INHIBITORS AND ANTI-CANCER AGENTS CHINA NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH CO., LTD. (CN) 2023-01-05 — — US disclosed
US-11420970-B1 Piperidinyl-methyl-purineamines as NSD2 inhibitors and anti-cancer agents NOVARTIS AG (CH) 2022-08-23 — — US disclosed
EP-4013755-A1 PIPERIDINYL-METHYL-PURINEAMINES AS NSD2 INHIBITORS AND ANTI-CANCER AGENTS Novartis AG (CH) 2022-06-22 — — EP disclosed
WO-2021028854-A1 PIPERIDINYL-METHYL-PURINEAMINES AS NSD2 INHIBITORS AND ANTI-CANCER AGENTS NOVARTIS AG (CH) 2021-02-18 — — 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 (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-11420970-B1 Piperidinyl-methyl-purineamines as NSD2 inhibitors and anti-cancer agents NSD2, NSD1, NSD3 BAZ2A 64/4885SLC6A9 2751/4885HDAC1 286/4885
US-20230002388-A1 PIPERIDINYL-METHYL-PURINEAMINES AS NSD2 INHIBITORS AND ANTI-CANCER AGENTS NSD2, NSD1, NSD3 BAZ2A 64/4885SLC6A9 2751/4885HDAC1 286/4885

“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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