SCHEMBL20911085

SCHEMBL20911085

Fc1ccccc1-c1cc2cc3c(cc2s1)sc1c2cc4cc(-c5ccccc5F)sc4cc2sc31

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A1 P04798 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ CYP1B1 Q16678 1/20 0.46
▸ STK17B O94768 1/20 0.34
▸ ESR1 P03372 3/20 0.33
▸ ESR2 Q92731 3/20 0.33
▸ ERN1 O75460 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ JAK2 O60674 1/20 0.32
▸ ALOX5AP P20292 1/20 0.32
▸ FEN1 P39748 1/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ MPL P40238 1/20 0.32
▸ SLC9A1 P19634 1/20 0.32
▸ BACE1 P56817 1/20 0.31
▸ TRPA1 O75762 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ ESRRG P62508 1/20 0.31

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
SCHEMBL20911080 0.80 RPS6KA3 (0.31) ESR1ESR2
SCHEMBL25165728 0.78 CYP1A1 (0.41) CYP1A1CYP1A2CYP1B1STK17BESR1
SCHEMBL20910613 0.77 APP (0.46) STK17BESR1ESR2ERN1
SCHEMBL20911084 0.77 ESR1 (0.53) CYP1A1CYP1B1ESR1ESR2KDM4E
SCHEMBL20911048 0.77 GABRG2 (0.33) —
SCHEMBL28073078 0.76 CYP1A1 (0.53) CYP1A1CYP1A2CYP1B1ERN1NPC1
SCHEMBL20910623 0.75 — —
SCHEMBL20910622 0.75 MAPT (0.33) ALDH1A1MEN1KMT2A
SCHEMBL20910620 0.74 ESR1 (0.30) ESR1ESR2
SCHEMBL5685590 0.73 CYP1A1 (0.47) CYP1A1CYP1A2CYP1B1ESR1ESR2

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-11242357-B2 Fused polycyclic heteroaromatic compound and organic thin film and electronic device SAMSUNG ELECTRONICS CO., LTD. (KR) 2022-02-08 — — US disclosed
US-20190112319-A1 FUSED POLYCYCLIC HETEROAROMATIC COMPOUND AND ORGANIC THIN FILM AND ELECTRONIC DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2019-04-18 — — 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-11242357-B2 Fused polycyclic heteroaromatic compound and organic thin film and electronic device TET1, SLC43A1, OCIAD1 CYP1A1 64/4885CYP1A2 511/4885CYP1B1 41/4885
US-20190112319-A1 FUSED POLYCYCLIC HETEROAROMATIC COMPOUND AND ORGANIC THIN FILM AND ELECTRONIC DEVICE TET1, SLC43A1, OCIAD1 CYP1A1 64/4885CYP1A2 511/4885CYP1B1 41/4885

“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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