SCHEMBL5583005

SCHEMBL5583005

Nc1ccc(C(=O)C2CCCNC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.51
CYP2D6 P10635 2/20 0.51
KDM4E B2RXH2 1/20 0.51
MAPT P10636 1/20 0.51
ATM Q13315 1/20 0.51
SLC6A1 P30531 2/20 0.49
SLC6A11 P48066 1/20 0.49
TSHR P16473 1/20 0.49
LMNA P02545 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
SLC6A13 Q9NSD5 1/20 0.49
ULK1 O75385 1/20 0.44
MEN1 O00255 1/20 0.44
MGLL Q99685 1/20 0.43
NOS2 P35228 1/20 0.43
SRD5A2 P31213 1/20 0.41
SLC18A3 Q16572 1/20 0.40
TNKS O95271 1/20 0.40
TNKS2 Q9H2K2 1/20 0.40
ROCK2 O75116 1/20 0.39

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
SCHEMBL2323451 0.84 HSD11B1 (0.49) KMT2ACYP2D6KDM4EMAPTATM
SCHEMBL7001156 0.84 KMT2A (0.64) KMT2ACYP2D6KDM4EMAPTATM
SCHEMBL4671412 0.84 MGLL (0.49) KMT2ACYP2D6KDM4EMAPTATM
SCHEMBL638646 0.83 SLC6A1 (0.56) KMT2ACYP2D6KDM4EMAPTATM
Hydrochloric Acid SCHEMBL5478791 0.83 HSD11B1 (0.48) KMT2ACYP2D6KDM4EMAPTATM
Hydrochloric Acid SCHEMBL4028302 0.82 SLC6A1 (0.55) KMT2ACYP2D6KDM4EMAPTATM
SCHEMBL16615303 0.81 SRD5A2 (0.59) KMT2ACYP2D6MEN1MGLLSRD5A2
SCHEMBL11799390 0.80 SLC6A1 (0.45) KMT2ACYP2D6KDM4EMAPTATM
SCHEMBL11798075 0.80 NPC1 (0.59) KMT2ASLC6A1SLC6A11LMNASMN1; SMN2
SCHEMBL18203121 0.80 MEN1 (0.67) KMT2ACYP2D6TSHRMEN1MGLL

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-20070173498-A1 Melanin concentrating hormone antagonist KATO KANEYOSHI 2007-07-26 US disclosed
US-7115750-B1 Melanin concentrating hormone antagonist TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-10-03 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-20070173498-A1 Melanin concentrating hormone antagonist MC1R, MCHR1, MCHR2 KMT2A 1886/4885CYP2D6 2688/4885KDM4E 2952/4885

“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.