SCHEMBL30540792

SCHEMBL30540792

c1ccc2c(C3CCCCO3)n[nH]c2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 6/20 0.42
▸ NPC1 O15118 4/20 0.42
▸ KDM4E B2RXH2 6/20 0.40
▸ GAA P10253 2/20 0.40
▸ PDPK1 O15530 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ ALDH1A1 P00352 5/20 0.38
▸ HPGD P15428 2/20 0.38
▸ ALPL P05186 1/20 0.38
▸ IDO1 P14902 1/20 0.38
▸ TTK P33981 1/20 0.38
▸ MAPK10 P53779 1/20 0.38
▸ PIM1 P11309 1/20 0.36
▸ PIM2 Q9P1W9 1/20 0.36
▸ LRRK2 Q5S007 1/20 0.36
▸ CYP1A2 P05177 1/20 0.35
▸ MAPK8 P45983 1/20 0.34
▸ MAPK9 P45984 1/20 0.34
▸ IRAK4 Q9NWZ3 1/20 0.34
▸ NPSR1 Q6W5P4 2/20 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
SCHEMBL5562287 0.95 KDM4E (0.41) RAB9ANPC1KDM4EGAAPDPK1
SCHEMBL30823749 0.80 GSK3B (0.42) KDM4EPDPK1PIM1PIM2AURKA
SCHEMBL29705459 0.78 GRM4 (0.38) MAPK10PIM1PIM2MAPK8MAPK9
SCHEMBL1114154 0.78 KDM4E (0.37) RAB9ANPC1KDM4EGAAPDPK1
SCHEMBL31295238 0.78 DRD2 (0.52) KDM4EGAAPDPK1CYP3A4
SCHEMBL3402451 0.77 GAA (0.44) KDM4EGAAALDH1A1TTKMAPK10
SCHEMBL31586483 0.77 GAA (0.38) RAB9ANPC1GAAPDPK1ALDH1A1
SCHEMBL4004747 0.77 RAB9A (0.48) RAB9ANPC1KDM4EGAAPDPK1
SCHEMBL30706586 0.77 PIM1 (0.35) RAB9ANPC1KDM4EALDH1A1PIM1
SCHEMBL3668219 0.75 NUDT1 (0.35) PIM1PIM2

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-20260060961-A1 SUBSTITUTED HETEROCYCLES AS RAS INHIBITORS JAZZ PHARMACEUTICALS IRELAND LTD (IE) 2026-03-05 — — US disclosed
WO-2024032584-A1 PROTEIN TYROSINE KINASE INHIBITOR AND MEDICAL USE THEREOF 苏州必扬医药科技有限公司 2024-02-15 — — WO disclosed
CN-116761798-A Indazoles as kinase inhibitors 泰拉生物科学公司 2023-09-15 — — CN 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-20260060961-A1 SUBSTITUTED HETEROCYCLES AS RAS INHIBITORS KRAS, NRAS, HRAS RAB9A 27/4885NPC1 789/4885KDM4E 4333/4885

“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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