SCHEMBL25794052

SCHEMBL25794052

CCCc1c(C)c2cccc3ccn1c32

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 1/20 0.36
▸ MAPT P10636 3/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ ALKBH5 Q6P6C2 1/20 0.35
▸ HCRTR1 O43613 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ KDM4E B2RXH2 5/20 0.34
▸ ALDH1A1 P00352 3/20 0.34
▸ TSHR P16473 3/20 0.34
▸ LMNA P02545 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ KMT2A Q03164 1/20 0.33
▸ HSP90AB1 P08238 1/20 0.33
▸ HTR2A P28223 2/20 0.32
▸ HTR2C P28335 1/20 0.32
▸ HPGD P15428 2/20 0.32
▸ GAA P10253 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
SCHEMBL25794054 0.77 ALDH1A1 (0.39) PTGS2MAPTSMN1; SMN2HCRTR1TP53
SCHEMBL25794053 0.68 ALKBH5 (0.45) MAPTSMN1; SMN2ALKBH5ALOX15MAPK1
SCHEMBL5229741 0.63 KDM4E (0.57) MAPTSMN1; SMN2ALKBH5RAB9AKDM4E
SCHEMBL11723137 0.63 KDM4E (0.51) MAPTSMN1; SMN2ALKBH5KDM4EALDH1A1
SCHEMBL31190839 0.62 ALKBH5 (0.41) PTGS2MAPTALKBH5KDM4EALDH1A1
SCHEMBL11717839 0.62 ALDH1A1 (0.51) SMN1; SMN2ALKBH5KDM4EALDH1A1TSHR
SCHEMBL4512211 0.62 ALKBH5 (0.41) PTGS2MAPTALKBH5KDM4EALDH1A1
SCHEMBL10264882 0.62 CMA1 (0.43) HTR1A
SCHEMBL1696888 0.61 OXER1 (0.40) HTR2AHTR2CHTR1A
Hydrochloric Acid SCHEMBL27528480 0.61 ALKBH5 (0.40) PTGS2MAPTALKBH5KDM4EALDH1A1

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-11697653-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2023-07-11 — — 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-11697653-B2 Organic electroluminescent materials and devices L1CAM, SOD1, EPCAM PTGS2 2781/4885MAPT 1969/4885SMN1; SMN2 2430/4885

“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.

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