SCHEMBL6702001

SCHEMBL6702001

CNC(=O)NC(=N)NCc1cccc2ccccc12

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 2/20 0.59
KMT2A Q03164 2/20 0.56
MEN1 O00255 1/20 0.56
MAPT P10636 1/20 0.56
ANPEP P15144 1/20 0.49
CHRNB2 P17787 1/20 0.48
CHRNA4 P43681 1/20 0.48
NQO2 P16083 1/20 0.47
BCHE P06276 1/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
CA2 P00918 1/20 0.46
P2RX7 Q99572 1/20 0.45
ATM Q13315 1/20 0.45

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
SCHEMBL27876122 0.87 MTNR1A (0.49) MTNR1AKMT2AMEN1MAPTANPEP
SCHEMBL6702035 0.85 KMT2A (0.55) MTNR1AKMT2AMEN1MAPTANPEP
SCHEMBL6700488 0.84 KMT2A (0.51) MTNR1AKMT2AMEN1MAPTANPEP
SCHEMBL6703871 0.84 CA12 (0.52) MTNR1AKMT2AMEN1MAPTANPEP
SCHEMBL6702025 0.84 KMT2A (0.51) MTNR1AKMT2AMEN1MAPTANPEP
SCHEMBL6697457 0.82 KMT2A (0.62) MTNR1AKMT2AMEN1MAPTANPEP
SCHEMBL6698279 0.82 KMT2A (0.51) MTNR1AKMT2AMEN1MAPTANPEP
SCHEMBL6702054 0.81 MTNR1A (0.54) MTNR1AKMT2AMEN1MAPTANPEP
SCHEMBL6702058 0.81 MTNR1A (0.54) MTNR1AKMT2AMEN1MAPTANPEP
SCHEMBL6704795 0.81 MEN1 (0.51) MTNR1AKMT2AMEN1MAPTANPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040044037-A1 Amidino-urea serotonin receptor ligands and compositions, their pharmaceutical uses, and methods for their snythesis HONG YUFENG (US) 2004-03-04 US disclosed
EP-1332127-A2 AMIDINO-UREA SEROTONIN RECEPTOR LIGANDS AND COMPOSITIONS, THEIR PHARMACEUTICAL USES, AND METHODS FOR THEIR SNYTHESIS Warner-Lambert Company LLC (US) 2003-08-06 EP disclosed
WO-2002036554-A2 AMIDINO-UREA SEROTONIN RECEPTOR LIGANDS AND COMPOSITIONS, THEIR PHARMACEUTICAL USES, AND METHODS FOR THEIR SNYTHESIS WARNER-LAMBERT COMPANY LLC (US) 2002-05-10 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-20040044037-A1 Amidino-urea serotonin receptor ligands and compositions, their pharmaceutical uses, and methods for their snythesis HTR7, HTR1A, HTR2C MTNR1A 97/4885KMT2A 4351/4885MEN1 3611/4885

“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.