SCHEMBL17175253

SCHEMBL17175253

CC(C)=C1C(=O)Oc2cc3ccccc3cc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
POLB P06746 1/20 0.37
CASP6 P55212 1/20 0.37
TYMS P04818 1/20 0.35
DHODH Q02127 1/20 0.35
MAOB P27338 5/20 0.34
HTR2C P28335 1/20 0.34
HTR2B P41595 1/20 0.34
HTR3A P46098 1/20 0.34
KDM4E B2RXH2 2/20 0.33
CA12 O43570 1/20 0.33
CYP1A2 P05177 1/20 0.33
NT5E P21589 1/20 0.33
CA9 Q16790 1/20 0.33
ADORA2A P29274 3/20 0.33
TMIGD3 P0DMS9 2/20 0.33
ADORA1 P30542 2/20 0.33
BRD4 O60885 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
SCHEMBL17175231 0.91 TYMS (0.31) TYMSMAOBMAOA
SCHEMBL17175235 0.85 CYP19A1 (0.31)
SCHEMBL17175239 0.79 TDP1 (0.42) MAPTSMN1; SMN2NPSR1TYMSMAOB
SCHEMBL17179157 0.72 TYMS (0.38) MAPTSMN1; SMN2NPSR1POLBCASP6
SCHEMBL13397739 0.69 DHODH (0.38) POLBCASP6TYMSDHODHMAOB
SCHEMBL17175232 0.69
SCHEMBL18159595 0.68 MAPK1 (0.46) MAPTSMN1; SMN2NPSR1POLBCASP6
SCHEMBL103 0.67 ALOX15 (0.60) POLBTYMSMAOBKDM4EGSTP1
SCHEMBL30083328 0.67 ALOX15 (0.60) POLBTYMSMAOBKDM4EGSTP1
SCHEMBL12852223 0.66 HTR2A (0.40) POLBCASP6DHODHMAOBKDM4E

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-20150295179-A1 MONOMERIC, OLIGOMERIC AND POLYMERIC SEMICONDUCTORS CONTAINING FUSED RINGS AND THEIR DEVICES LI YUNING (US) 2015-10-15 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-20150295179-A1 MONOMERIC, OLIGOMERIC AND POLYMERIC SEMICONDUCTORS CONTAINING FUSED RINGS AND THEIR DEVICES PICALM, NOD2, CDH1 MAPT 18/4885SMN1; SMN2 3728/4885NPSR1 3315/4885

“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.