SCHEMBL30189966

SCHEMBL30189966

Cc1cc(OCCNC(=O)OC(C)(C)C)nc2sc(Br)nc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA9 Q16790 2/20 0.40
IKBKB O14920 3/20 0.38
STK17B O94768 1/20 0.38
STK17A Q9UEE5 1/20 0.38
LCK P06239 3/20 0.37
BRD4 O60885 2/20 0.37
PDK2 Q15119 1/20 0.36
AAK1 Q2M2I8 1/20 0.36
FPR3 P25089 2/20 0.35
FPR2 P25090 2/20 0.35
IDO1 P14902 1/20 0.35
LMNA P02545 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
HTT P42858 1/20 0.35

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
SCHEMBL19782947 1.00 CA12 (0.40) CA12CA1CA2CA9IKBKB
SCHEMBL30189931 0.88 IKBKB (0.42) CA12CA1CA2CA9IKBKB
SCHEMBL19783605 0.88 IKBKB (0.42) CA12CA1CA2CA9IKBKB
SCHEMBL22341973 0.86 IKBKB (0.42) IKBKBLMNACYP1A2CYP3A4CYP2C9
SCHEMBL21395510 0.80 CA12 (0.45) CA12CA1CA2CA9STK17B
SCHEMBL30189776 0.80 CA12 (0.45) CA12CA1CA2CA9STK17B
SCHEMBL30189803 0.78 F2RL3 (0.48) CYP3A4
SCHEMBL31113971 0.78 F2RL3 (0.48) CYP3A4
SCHEMBL19783132 0.78 F2RL3 (0.48) CYP3A4
SCHEMBL22917487 0.74 STK17B (0.49) CA12CA1CA2CA9STK17B

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-12060347-B2 Bicyclic heteroaryl substituted compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2024-08-13 US disclosed
CN-109689647-B Bicyclic heteroaryl substituted compounds 百时美施贵宝公司 2023-01-20 CN 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-12060347-B2 Bicyclic heteroaryl substituted compounds F2, F2RL3, F12 CA12 3794/4885CA1 3155/4885CA2 2280/4885

“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.