SCHEMBL24324680

SCHEMBL24324680

CC#Cc1cc(C)c(C2C(=O)CC3(CCN(C(=O)C(=O)Nc4ccccn4)CC3)CC2=O)c(C)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.35
RAB9A P51151 3/20 0.35
PKM P14618 1/20 0.35
ALDH1A1 P00352 4/20 0.34
HTT P42858 4/20 0.34
KDM4E B2RXH2 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
BTK Q06187 4/20 0.34
GRM5 P41594 1/20 0.33
IDO1 P14902 1/20 0.33
GAA P10253 2/20 0.33
RIPK1 Q13546 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
TSHR P16473 1/20 0.33
CYP2C19 P33261 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
POLB P06746 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
SCHEMBL22992106 0.91 FAAH (0.38) ALDH1A1HTTKDM4EBTKGRM5
SCHEMBL24324679 0.87 NPC1 (0.37) NPC1RAB9APKMALDH1A1HTT
SCHEMBL22942017 0.84 NPC1 (0.41) NPC1RAB9APKMALDH1A1SMN1; SMN2
SCHEMBL21344636 0.83 L3MBTL1 (0.44) ALDH1A1SMN1; SMN2GAACYP3A4CYP2D6
SCHEMBL22345626 0.83 FASN (0.31)
SCHEMBL22942059 0.81 RAB9A (0.35) NPC1RAB9APKMALDH1A1KDM4E
SCHEMBL22992194 0.81 TRPV1 (0.36) NPC1RAB9AALDH1A1SMN1; SMN2KMT2A
SCHEMBL22992236 0.81 NAMPT (0.38) ALDH1A1KDM4ESMN1; SMN2CYP2D6TSHR
SCHEMBL24325236 0.81
SCHEMBL24325242 0.81 GRM5 (0.32) GRM5

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-20220117228-A1 SUBSTITUTED AZASPIRO-CYCLES AS HERBICIDES SYNGENTA CROP PROTECTION AG (CH) 2022-04-21 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-20220117228-A1 SUBSTITUTED AZASPIRO-CYCLES AS HERBICIDES DDT, DHFR, CCNB3 NPC1 4792/4885RAB9A 2861/4885PKM 3129/4885

“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.