SCHEMBL20535852

SCHEMBL20535852

Brc1ccc(CNCC23CC4CC(CC(C4)C2)C3)cn1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 10/20 0.54
HDAC3 O15379 1/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC2 Q92769 1/20 0.50
P2RX7 Q99572 6/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
FLT3 P36888 1/20 0.41
TYRO3 Q06418 1/20 0.41
MERTK Q12866 1/20 0.41
GAS6 Q14393 1/20 0.41

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
SCHEMBL16884220 0.79 HDAC6 (0.52) HDAC6HDAC3HDAC1MEN1KMT2A
SCHEMBL20535519 0.74 HDAC6 (0.48) HDAC6HDAC3HDAC1HDAC2P2RX7
SCHEMBL18088397 0.74 HDAC6 (0.61) HDAC6HDAC3HDAC1HDAC2P2RX7
SCHEMBL10067533 0.73 P2RX7 (0.67) HDAC6HDAC3HDAC1HDAC2P2RX7
SCHEMBL13927593 0.71 KCNH2 (0.44) HDAC6HDAC3HDAC1MEN1KMT2A
SCHEMBL1347586 0.71 KDM1A (0.51) HDAC6HDAC3HDAC1HDAC2P2RX7
SCHEMBL18085885 0.71 HDAC6 (0.57) HDAC6HDAC3HDAC1HDAC2P2RX7
SCHEMBL20535185 0.70 HDAC6 (1.00) HDAC6HDAC3HDAC1HDAC2P2RX7
SCHEMBL7662002 0.70 CYP11B1 (0.40)
SCHEMBL9080180 0.69 HDAC6 (0.54) HDAC6HDAC3HDAC1HDAC2P2RX7

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200071326-A1 TAM KINASE INHIBITORS SYROS PHARMACEUTICALS INC (US) 2020-03-05 US disclosed
US-20200071326-A1 TAM KINASE INHIBITORS SYROS PHARMACEUTICALS INC (US) 2020-03-05 US disclosed
WO-2018191587-A1 TAM KINASE INHIBITORS SYROS PHARMACEUTICALS, INC. (US) 2018-10-18 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-20200071326-A1 TAM KINASE INHIBITORS PIK3CA, MAP3K1, MAP3K5 HDAC6 1041/4885HDAC3 609/4885HDAC1 633/4885

“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.