SCHEMBL18205653

SCHEMBL18205653

CCC(C)NC(=O)c1cc(C)cc(C)c1OC

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.56
ALDH1A1 P00352 3/20 0.51
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
SMN1; SMN2 Q16637 4/20 0.46
TAS1R3 Q7RTX0 2/20 0.45
TAS1R1 Q7RTX1 2/20 0.45
TAS1R2 Q8TE23 1/20 0.45
TSHR P16473 2/20 0.45
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
MCL1 Q07820 1/20 0.43
TP53 P04637 2/20 0.41
NPC1 O15118 1/20 0.41
STAT1 P42224 1/20 0.41
RAB9A P51151 1/20 0.41
HSD17B10 Q99714 1/20 0.41
POLB P06746 1/20 0.40
HTT P42858 1/20 0.40
NR3C1 P04150 1/20 0.40

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
SCHEMBL18205647 0.81 MEN1 (0.59) MAPK1ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL4162633 0.77 TSHR (0.63) MAPK1ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL29062264 0.75 KDM4E (0.54) MAPK1ALDH1A1SMN1; SMN2TAS1R3TAS1R1
SCHEMBL10920134 0.74 KDM4E (0.55) ALDH1A1MEN1KMT2AHSD17B10POLB
SCHEMBL18205663 0.74 MEN1 (0.57) MAPK1ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL9720570 0.73 ALDH1A1 (0.51) ALDH1A1MEN1KMT2ATSHRHTT
SCHEMBL9191019 0.73 KDM4E (0.53) ALDH1A1HSD17B10PKM
SCHEMBL12345885 0.73 KDM4E (0.46) ALDH1A1MEN1KMT2AMCL1NPC1
SCHEMBL8607391 0.72 PDCD1LG2 (0.39) MAPK1ALDH1A1POLB
SCHEMBL8431119 0.71 KDM4E (0.41) MAPK1ALDH1A1MEN1KMT2ASMN1; SMN2

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-10167269-B2 Cockroach attraction-aggregation substance, cockroach aggregation attractant and cockroach controlling agent KYOTO UNIVERSITY (JP) 2019-01-01 US disclosed
US-20160326129-A1 COCKROACH ATTRACTION-AGGREGATION SUBSTANCE, COCKROACH AGGREGATION ATTRACTANT AND COCKROACH CONTROLLING AGENT KYOTO UNIVERSITY (JP) 2016-11-10 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 (2 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-20160326129-A1 COCKROACH ATTRACTION-AGGREGATION SUBSTANCE, COCKROACH AGGREGATION ATTRACTANT AND COCKROACH CONTROLLING AGENT ACHE, STOM, NAPA MAPK1 2128/4885ALDH1A1 4126/4885MEN1 2121/4885
US-10167269-B2 Cockroach attraction-aggregation substance, cockroach aggregation attractant and cockroach controlling agent ACHE, STOM, NAPA MAPK1 2128/4885ALDH1A1 4126/4885MEN1 2121/4885

“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.