SCHEMBL19972615

SCHEMBL19972615

CC(C)N(C)C(=O)c1cc(F)ccc1-n1c(=S)n(C2CCCN(C(=O)OC(C)(C)C)C2)c2ccncc21

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.38
GPBAR1 Q8TDU6 2/20 0.38
CYP2C9 P11712 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
BLK P51451 3/20 0.37
BTK Q06187 1/20 0.36
LYN P07948 2/20 0.35
POLB P06746 1/20 0.35
SCN9A Q15858 1/20 0.35
ALOX5AP P20292 1/20 0.34
FEN1 P39748 1/20 0.34
LMNA P02545 1/20 0.34
CCNT1 O60563 1/20 0.34
CDK9 P50750 1/20 0.34
EGFR P00533 1/20 0.34

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
SCHEMBL30524054 1.00 GPR119 (0.38) GPR119GPBAR1CYP2C9SMN1; SMN2BLK
SCHEMBL19972584 0.90 SMN1; SMN2 (0.44) GPR119GPBAR1CYP2C9SMN1; SMN2BLK
SCHEMBL19972487 0.84 GPR119 (0.43) GPR119SMN1; SMN2BLKBTKLYN
SCHEMBL19972553 0.81 GPBAR1 (0.39) GPR119GPBAR1CYP2C9SMN1; SMN2BTK
SCHEMBL19972721 0.81 RPS6KA5 (0.34) GPBAR1CCNT1CDK9
SCHEMBL19980644 0.80 SCN9A (0.42) GPR119GPBAR1CYP2C9SMN1; SMN2POLB
SCHEMBL30266156 0.80 SCN9A (0.42) GPR119GPBAR1CYP2C9SMN1; SMN2POLB
SCHEMBL19972693 0.80 SMN1; SMN2 (0.40) GPR119GPBAR1CYP2C9SMN1; SMN2POLB
SCHEMBL19980629 0.78 SMN1; SMN2 (0.42) GPR119GPBAR1SMN1; SMN2POLBSCN9A
SCHEMBL30265985 0.78 SMN1; SMN2 (0.42) GPR119GPBAR1SMN1; SMN2POLBSCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240124447-A1 INHIBITORS OF THE MENIN-MLL INTERACTION VITAE PHARMACEUTICALS, LLC (US) 2024-04-18 US disclosed
US-11739085-B2 Inhibitors of the menin-MLL interaction VITAE PHARMACEUTICALS, LLC (US) 2023-08-29 US disclosed
US-11739085-B2 Inhibitors of the menin-MLL interaction VITAE PHARMACEUTICALS, LLC (US) 2023-08-29 US disclosed
EP-4230627-A2 INHIBITORS OF THE MENIN-MLL INTERACTION Vitae Pharmaceuticals, LLC (US) 2023-08-23 EP disclosed
EP-3512850-B1 INHIBITORS OF THE MENIN-MLL INTERACTION VITAE PHARMACEUTICALS LLC (US) 2023-04-12 EP disclosed
US-20210179611-A1 INHIBITORS OF THE MENIN-MLL INTERACTION VITAE PHARMACEUTICALS, LLC (US) 2021-06-17 US disclosed
US-10899758-B2 Inhibitors of the menin-MLL interaction VITAE PHARMACEUTICALS, LLC (US) 2021-01-26 US disclosed
EP-3512850-A1 INHIBITORS OF THE MENIN-MLL INTERACTION Vitae Pharmaceuticals, Inc. (US) 2019-07-24 EP disclosed
US-20190202830-A1 INHIBITORS OF THE MENIN-MLL INTERACTION VITAE PHARMACEUTICALS, INC. 2019-07-04 US disclosed
US-20190202830-A1 INHIBITORS OF THE MENIN-MLL INTERACTION VITAE PHARMACEUTICALS, INC. 2019-07-04 US disclosed
WO-2018053267-A1 INHIBITORS OF THE MENIN-MLL INTERACTION VITAE PHARMACEUTICALS, INC. (US) 2018-03-22 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 (5 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-11739085-B2 Inhibitors of the menin-MLL interaction MLLT1, MEN1, MLLT3 GPR119 3311/4885GPBAR1 3700/4885CYP2C9 4667/4885
US-10899758-B2 Inhibitors of the menin-MLL interaction MLLT1, MEN1, MLLT3 GPR119 3311/4885GPBAR1 3700/4885CYP2C9 4667/4885
US-20190202830-A1 INHIBITORS OF THE MENIN-MLL INTERACTION MLLT1, MEN1, MLLT3 GPR119 3311/4885GPBAR1 3700/4885CYP2C9 4667/4885
US-20240124447-A1 INHIBITORS OF THE MENIN-MLL INTERACTION MLLT1, MEN1, MLLT3 GPR119 3311/4885GPBAR1 3700/4885CYP2C9 4667/4885
US-20210179611-A1 INHIBITORS OF THE MENIN-MLL INTERACTION MLLT1, MEN1, MLLT3 GPR119 3311/4885GPBAR1 3700/4885CYP2C9 4667/4885

“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.