SCHEMBL23257971

SCHEMBL23257971

Cn1cc(CCCO)nc(N2CCCCCCCCC2)c1=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.35
MEN1 O00255 3/20 0.35
CYP3A4 P08684 2/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 2/20 0.35
SLC29A1 Q99808 9/20 0.35
ALDH1A1 P00352 6/20 0.35
KDM4E B2RXH2 2/20 0.35
GAA P10253 2/20 0.35
TSHR P16473 2/20 0.35
PDE2A O00408 1/20 0.35
RGS12 O14924 1/20 0.35
SLC22A2 O15244 1/20 0.35
SLC22A1 O15245 1/20 0.35
ABCC4 O15439 1/20 0.35
ABCC5 O15440 1/20 0.35
PDE6D O43924 1/20 0.35
PDE8A O60658 1/20 0.35
GMNN O75496 1/20 0.35
USP2 O75604 1/20 0.35

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
SCHEMBL21564593 0.80 SLC29A1 (0.33) KMT2AMEN1CYP3A4CYP2C9CYP2C19
SCHEMBL21553077 0.79 DGAT1 (0.35) KMT2AMEN1SLC29A1PDE10A
SCHEMBL21553144 0.76 NPC1 (0.39) KMT2AMEN1ALDH1A1KDM4ETSHR
SCHEMBL21564592 0.76
SCHEMBL21552859 0.74 DGAT1 (0.36) PDE5APDE10A
SCHEMBL21564759 0.73 SLC29A1 (0.33) SLC29A1ALDH1A1TSHRHSD17B10
SCHEMBL21552864 0.70 DGAT1 (0.39) PDE5APDE10ASYK
SCHEMBL21564491 0.70 MEN1 (0.42) KMT2AMEN1CYP3A4ALDH1A1LMNA
SCHEMBL28075247 0.69 TSHR (0.33) ALDH1A1TSHRMAPT
SCHEMBL21564585 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11578059-B2 KDM1A inhibitors for the treatment of disease Imago Biosciences. Inc. (US) 2023-02-14 US disclosed
US-20210115023-A1 KDM1A INHIBITORS FOR THE TREATMENT OF DISEASE IMAGO BIOSCIENCES, INC. 2021-04-22 US 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-20210115023-A1 KDM1A INHIBITORS FOR THE TREATMENT OF DISEASE KDM1A, KDM1B, KDM2A KMT2A 17/4885MEN1 3213/4885CYP3A4 4123/4885
US-11578059-B2 KDM1A inhibitors for the treatment of disease KDM1B, KDM1A, KDM2A KMT2A 17/4885MEN1 3684/4885CYP3A4 4184/4885

“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.