SCHEMBL7053059

SCHEMBL7053059

CCOc1ccc(S(=O)(=O)N2CCNCC2N2CCN(CC)CC2)cc1C(=O)Nc1c(CCCF)cn(CC)c1C(N)=O

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.38
PDE5A O76074 2/20 0.37
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.31
PKM P14618 1/20 0.31
APOBEC3A P31941 1/20 0.30
APOBEC3G Q9HC16 1/20 0.30
TSPO P30536 1/20 0.30
MRGPRX1 Q96LB2 1/20 0.30
LMNA P02545 1/20 0.30
TSHR P16473 1/20 0.30
MMP1 P03956 1/20 0.30
MMP9 P14780 1/20 0.30
MMP13 P45452 1/20 0.30
ADAM17 P78536 1/20 0.30

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
SCHEMBL7050684 0.96 KMT2A (0.34) KMT2APDE5AMEN1POLB
SCHEMBL7053105 0.95 PDE5A (0.34) KMT2APDE5AMEN1POLB
SCHEMBL7051114 0.95 PDE5A (0.34) KMT2APDE5APKM
SCHEMBL7057287 0.94 KMT2A (0.39) KMT2APDE5AMEN1POLBPKM
SCHEMBL7053575 0.93 KMT2A (0.32) KMT2APDE5AMEN1POLB
SCHEMBL7050993 0.93 KMT2A (0.34) KMT2APDE5AMEN1POLB
SCHEMBL7053379 0.92 PDE5A (0.36) KMT2APDE5AMEN1POLBTSPO
SCHEMBL7053061 0.91 PDE5A (0.35) PDE5A
SCHEMBL7049975 0.90 PDE5A (0.39) PDE5A
SCHEMBL7056316 0.90 KMT2A (0.35) KMT2APDE5AMEN1POLBTSPO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030171361-A1 Pyrrolopyrimidinone derivatives, process of preparation and use SK CHEMICALS CO., LTD. (KR) 2003-09-11 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 (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-20030171361-A1 Pyrrolopyrimidinone derivatives, process of preparation and use CYP2C19, DHPS, SDHA KMT2A 4373/4885PDE5A 686/4885MEN1 2829/4885

“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.