SCHEMBL19690249

SCHEMBL19690249

CC(C)(C)OC(=O)N1CCC(O)(c2cccc(Br)c2)CC1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ ATM Q13315 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ TACR1 P25103 1/20 0.45
▸ JAK2 O60674 1/20 0.44
▸ JAK1 P23458 1/20 0.44
▸ RORC P51449 2/20 0.44
▸ GPR119 Q8TDV5 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ BACE1 P56817 1/20 0.43
▸ USP30 Q70CQ3 2/20 0.43
▸ OPRD1 P41143 1/20 0.43
▸ OPRK1 P41145 1/20 0.43
▸ LMNA P02545 1/20 0.42
▸ FAAH O00519 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
SCHEMBL7541869 0.89 GPR119 (0.42) TSHRALOX15ATMALDH1A1TACR1
SCHEMBL15212259 0.87 RORC (0.48) TSHRALOX15ATMTACR1JAK2
SCHEMBL6812161 0.87 GPR119 (0.44) TSHRALOX15ATMTACR1RORC
SCHEMBL19331170 0.86 JAK2 (0.46) TSHRALOX15ATMTACR1JAK2
SCHEMBL7831565 0.86 GPR119 (0.54) TSHRALOX15ATMALDH1A1TACR1
SCHEMBL1430393 0.86 USP30 (0.51) TSHRALOX15ATMTACR1JAK2
SCHEMBL31694033 0.85 TSHR (0.52) TSHRALOX15ATMTACR1JAK2
SCHEMBL28029029 0.85 TSHR (0.52) TSHRALOX15ATMTACR1JAK2
SCHEMBL4293214 0.85 OPRM1 (0.49) TSHRALOX15ATMALDH1A1TACR1
SCHEMBL521464 0.85 NR1H2 (0.48) TSHRALOX15ATMALDH1A1TACR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3209664-B1 BICYCLIC HETEROARYL AMINE COMPOUNDS AS PI3K INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2020-06-03 — — EP disclosed
EP-3209664-B1 BICYCLIC HETEROARYL AMINE COMPOUNDS AS PI3K INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2020-06-03 — — EP disclosed
US-20170355707-A1 BICYCLIC HETEROARYL AMINE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2017-12-14 — — US disclosed
US-20170355707-A1 BICYCLIC HETEROARYL AMINE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2017-12-14 — — 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-20170355707-A1 BICYCLIC HETEROARYL AMINE COMPOUNDS PIK3R3, JAK2, JAK3 TSHR 289/4885ALOX15 3852/4885ATM 790/4885

“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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