SCHEMBL6568570

SCHEMBL6568570

NCC1(O)CCCc2ccc(F)cc21

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 5/20 0.53
SLC6A3 Q01959 4/20 0.41
SLC6A4 P31645 3/20 0.41
CYP17A1 P05093 3/20 0.38
CYP3A4 P08684 3/20 0.38
CYP11B2 P19099 3/20 0.38
CYP11B1 P15538 2/20 0.38
AKR1B1 P15121 3/20 0.37
RAD52 P43351 1/20 0.35
CHRNA7 P36544 1/20 0.33
TRPA1 O75762 1/20 0.33
HDAC4 P56524 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
SCHEMBL3896827 0.81 SIGMAR1 (0.36) KDM1AAKR1B1RAD52
SCHEMBL3910550 0.81 KDM1A (0.53) KDM1ASLC6A3SLC6A4
SCHEMBL1333907 0.78 KDM1A (0.47) KDM1ACYP3A4AKR1B1
SCHEMBL6567499 0.77 KDM1A (0.48) KDM1ACYP3A4
SCHEMBL8613008 0.76 AR (0.33) KDM1ASLC6A3SLC6A4HDAC4
SCHEMBL11086002 0.74 KDM4C (0.35) KDM1ASLC6A3SLC6A4CYP17A1CYP3A4
SCHEMBL7568312 0.74 AKR1B1 (0.41) KDM1AAKR1B1HDAC4
SCHEMBL30558325 0.73 APP (0.39) KDM1ACYP17A1CYP3A4CYP11B2CYP11B1
SCHEMBL17361959 0.73 APP (0.39) KDM1ACYP17A1CYP3A4CYP11B2CYP11B1
SCHEMBL11079385 0.72 SLC6A3 (0.42) SLC6A3SLC6A4CHRNA7

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-20040198791-A1 Fused imidazole derivative FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-10-07 US disclosed
EP-1403256-A1 FUSED IMIDAZOLE DERIVATIVE FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-03-31 EP 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-20040198791-A1 Fused imidazole derivative H1-0, H1-5, H1-3 KDM1A 2636/4885SLC6A3 3131/4885SLC6A4 2991/4885

“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.