SCHEMBL2425503

SCHEMBL2425503

O=C(c1ncc[nH]1)C1CC1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.45
RAB9A P51151 3/20 0.43
NPC1 O15118 2/20 0.43
SMN1; SMN2 Q16637 3/20 0.41
GLA P06280 1/20 0.37
JAK3 P52333 1/20 0.36
HTT P42858 1/20 0.36
HRH3 Q9Y5N1 1/20 0.35
LMNA P02545 1/20 0.35
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
HTR2B P41595 1/20 0.33

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
SCHEMBL2418976 0.92 JAK3 (0.44) KMT2ARAB9ANPC1SMN1; SMN2GLA
SCHEMBL26917154 0.92 KMT2A (0.42) KMT2ARAB9ANPC1SMN1; SMN2GLA
SCHEMBL2425813 0.91 JAK3 (0.47) KMT2ARAB9ANPC1SMN1; SMN2GLA
Bromide SCHEMBL6990879 0.88 HRH3 (0.47) KMT2ARAB9ANPC1SMN1; SMN2GLA
SCHEMBL6988822 0.85 HTR1F (0.41) KMT2ARAB9ANPC1SMN1; SMN2GLA
SCHEMBL26916539 0.80 KMT2A (0.40) KMT2ARAB9ANPC1SMN1; SMN2GLA
SCHEMBL31229951 0.77 NPC1 (0.47) KMT2ARAB9ANPC1SMN1; SMN2GLA
Cyclopropane Carboxylic Acid SCHEMBL2962866 0.77 KMT2A (0.40) KMT2ARAB9ANPC1JAK3LMNA
SCHEMBL1705485 0.76 NPC1 (0.40) KMT2ARAB9ANPC1SMN1; SMN2GLA
SCHEMBL6994122 0.76 MEN1 (0.52) KMT2ASMN1; SMN2LMNAALDH1A1

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 6 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
EP-1605752-B1 Sulfonamides for the treatment of congestive heart failure, their compositions and uses. CYTOKINETICS INC (US) 2011-09-14 EP disclosed
EP-1066237-A2 PROCESSES FOR PREPARING INTERMEDIATES AVENTIS CROPSCIENCE S.A. (FR) 2001-01-10 EP disclosed
WO-1999048851-A2 PROCESSES FOR PREPARING INTERMEDIATES AVENTIS CROPSCIENCE S.A. (FR) 1999-09-30 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 KMT2A 2250/4885RAB9A 2869/4885NPC1 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.