SCHEMBL21835567

SCHEMBL21835567

CON(C)C(=O)c1ccn(C2CCCCO2)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CD274 Q9NZQ7 1/20 0.39
▸ IDH1 O75874 1/20 0.36
▸ NPC1 O15118 5/20 0.33
▸ RAB9A P51151 5/20 0.33
▸ CYP4F2 P78329 1/20 0.33
▸ CYP4A11 Q02928 1/20 0.33
▸ KMT2A Q03164 3/20 0.32
▸ POLB P06746 2/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ SLC6A3 Q01959 2/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ ABL1 P00519 1/20 0.32
▸ HCRTR1 O43613 1/20 0.32
▸ HCRTR2 O43614 1/20 0.32
▸ S1PR1 P21453 1/20 0.31
▸ S1PR3 Q99500 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ RXRA P19793 1/20 0.31
▸ RXRB P28702 1/20 0.31

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
SCHEMBL24423466 0.83 KMT2A (0.47) CD274IDH1NPC1RAB9ACYP4F2
SCHEMBL22236106 0.79 CD274 (0.44) CD274IDH1CYP4F2CYP4A11KMT2A
SCHEMBL29835147 0.79 CYP4F2 (0.39) NPC1RAB9ACYP4F2CYP4A11POLB
SCHEMBL26916684 0.78 CD274 (0.44) CD274IDH1CYP4F2CYP4A11KMT2A
SCHEMBL16805004 0.77 CD274 (0.44) CD274IDH1NPC1RAB9AKMT2A
SCHEMBL29663267 0.76 S1PR1 (0.34) NPC1RAB9ACYP4F2CYP4A11SLC6A3
SCHEMBL24424192 0.74 TSHR (0.42) CD274NPC1RAB9APOLBTDP1
SCHEMBL29585576 0.74 CD274 (0.43) CD274NPC1RAB9AKMT2APOLB
SCHEMBL31178923 0.73 ABL1 (0.36) CD274NPC1RAB9ACYP4F2CYP4A11
SCHEMBL31178822 0.73 SLC6A3 (0.35) CD274NPC1RAB9APOLBSLC6A3

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-20240174683-A1 MAP4K1 INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2024-05-30 — — US disclosed
EP-4288437-A1 MAP4K1 INHIBITORS Bayer Aktiengesellschaft (DE) 2023-12-13 — — EP disclosed
WO-2022167627-A1 MAP4K1 INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2022-08-11 — — WO disclosed
WO-2020068846-A1 HETEROCYCLIC COMPOUND HETEROCYCLIC COMPOUND (US) 2020-04-02 — — 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 (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-20240174683-A1 MAP4K1 INHIBITORS MAP3K4, MAP4K4, MAP4K1 CD274 554/4885IDH1 2366/4885NPC1 3141/4885

“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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