SCHEMBL25814058

SCHEMBL25814058

CC1(C)c2ccc(-c3ccc(N(c4ccccc4)c4ccc(-c5ccc6c(c5)sc5ccccc56)cc4)cc3)cc2-c2cc(-c3ccccc3)cc(-c3ccccc3)c21

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
F9 P00740 1/20 0.33
ALK Q9UM73 1/20 0.32
RARA P10276 1/20 0.30
RARB P10826 1/20 0.30
RARG P13631 1/20 0.30
PTPN1 P18031 1/20 0.30

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
SCHEMBL25814059 0.98 ALDH1A1 (0.33) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL25814049 0.94 PIM3 (0.33) F9ALKRARARARBRARG
SCHEMBL25814050 0.93 PIM3 (0.34) F9ALKRARARARBRARG
SCHEMBL25814051 0.92 PIM3 (0.32) F9ALK
SCHEMBL25814060 0.92 ALK (0.33) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL25814082 0.91 F9 (0.31) F9
SCHEMBL20799850 0.90 ALK (0.34) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL25814067 0.90 PLA2G2A (0.31) ALK
SCHEMBL25814031 0.90 F9 (0.32) F9ALKPTPN1
SCHEMBL25814039 0.90 ALOX5 (0.41) F9ALK

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-20230225196-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-07-13 US disclosed
US-20230225196-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-07-13 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-20230225196-A1 MATERIALS FOR ELECTRONIC DEVICES SELE, EPHA6, EPX ALDH1A1 1837/4885MAPT 3046/4885HPGD 1132/4885

“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.