SCHEMBL27187150

SCHEMBL27187150

COc1ccc(COc2nc(C)nc3c2cc(Br)c2c3cnn2C(F)(F)F)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 1/20 0.38
▸ HDAC8 Q9BY41 1/20 0.38
▸ HDAC6 Q9UBN7 1/20 0.38
▸ HDAC5 Q9UQL6 1/20 0.38
▸ PDE2A O00408 1/20 0.37
▸ CNR1 P21554 2/20 0.34
▸ CNR2 P34972 2/20 0.34
▸ PDE1B Q01064 1/20 0.33
▸ XDH P47989 1/20 0.33
▸ LMNA P02545 3/20 0.33
▸ MAPT P10636 3/20 0.33
▸ HTT P42858 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ GABRA1 P14867 1/20 0.33
▸ GABRG2 P18507 1/20 0.33
▸ GABRB3 P28472 1/20 0.33
▸ GABRA5 P31644 1/20 0.33
▸ GABRA3 P34903 1/20 0.33
▸ GABRA2 P47869 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
SCHEMBL30739067 0.82 PDE2A (0.36) HDAC1HDAC8HDAC6HDAC5PDE2A
SCHEMBL27186549 0.81 PDE2A (0.38) PDE2ACNR1CNR2LMNAHTT
SCHEMBL27186677 0.75 CNR2 (0.41) PDE2ACNR1CNR2LMNAMAPT
SCHEMBL27186566 0.75 PDE2A (0.41) PDE2ACNR1CNR2LMNAHTT
SCHEMBL29799700 0.75 PDE2A (0.41) PDE2ACNR1CNR2LMNAHTT
SCHEMBL29799723 0.75 PDE2A (0.39) HDAC8PDE2ACNR1CNR2LMNA
SCHEMBL27187159 0.75 PDE2A (0.39) HDAC8PDE2ACNR1CNR2LMNA
SCHEMBL29799721 0.73 PDE2A (0.39) PDE2ACNR1CNR2LMNAMAPT
SCHEMBL27186791 0.73 PDE2A (0.39) PDE2ACNR1CNR2LMNAMAPT
SCHEMBL14616496 0.68 PDE2A (0.46) PDE2ACNR1CNR2LMNAHTT

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-20240109891-A1 NOVEL SUBSTITUTED TRICYCLIC AZA-HETEROCYCLES AS SOS1 INHIBITORS VIVA STAR BIOSCIENCES (SUZHOU) CO., LTD. (CN) 2024-04-04 — — US disclosed
WO-2022187236-A1 NOVEL SUBSTITUTED TRICYCLIC AZA-HETEROCYCLES AS SOS1 INHIBITORS VIVA STAR BIOSCIENCES (SUZHOU) CO., LTD. (CN) 2022-09-09 — — WO 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-20240109891-A1 NOVEL SUBSTITUTED TRICYCLIC AZA-HETEROCYCLES AS SOS1 INHIBITORS SOS1, SOS2, KSR1 HDAC1 966/4885HDAC8 1516/4885HDAC6 2646/4885

“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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