SCHEMBL6710137

SCHEMBL6710137

N#Cc1ccc(NC(=O)c2cc3cccc(NC(=O)CC4CCCC4)c3[nH]2)c(-c2nnn[nH]2)c1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.43
TSHR P16473 1/20 0.42
NAMPT P43490 3/20 0.38
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
P2RX7 Q99572 1/20 0.35
CHRM1 P11229 1/20 0.34
PARP14 Q460N5 1/20 0.34
DRD2 P14416 2/20 0.33
DRD3 P35462 2/20 0.33
AAK1 Q2M2I8 1/20 0.33
RORC P51449 3/20 0.32
CYP2D6 P10635 1/20 0.32
HTR1D P28221 1/20 0.32
HTR1B P28222 1/20 0.32

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
SCHEMBL6713287 0.89 AAK1 (0.42) KMT2ANAMPTNPC1RAB9ASMN1; SMN2
SCHEMBL6711770 0.88 GSK3B (0.37) KMT2ANPC1RAB9ASMN1; SMN2PARP14
SCHEMBL6711579 0.88 CHRM1 (0.41) NAMPTNPC1RAB9ASMN1; SMN2P2RX7
SCHEMBL6713895 0.88 GSK3B (0.37) NPC1RAB9ASMN1; SMN2
SCHEMBL6711962 0.88 ALDH1A1 (0.35) KMT2ANPC1RAB9ASMN1; SMN2DRD2
SCHEMBL6709018 0.87 PKM (0.35) PARP14
SCHEMBL6709998 0.87 GSK3B (0.37) KMT2ANPC1RAB9ASMN1; SMN2PARP14
SCHEMBL6709971 0.87 GSK3B (0.40) PARP14DRD2DRD3
SCHEMBL6711789 0.86 PARP14 (0.36) NAMPTPARP14
SCHEMBL6711369 0.86 KMT2A (0.42) KMT2ATSHRNAMPTNPC1RAB9A

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-20040142981-A1 Antibacterial benzoic acid derivatives PHARMACIA & UPJOHN COMPANY 2004-07-22 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 (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-20040142981-A1 Antibacterial benzoic acid derivatives GABRD, PHB1, GABBR1 KMT2A 3181/4885TSHR 3901/4885NAMPT 2506/4885

“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.