SCHEMBL27035682

SCHEMBL27035682

CC1(c2ccc(N)cc2)CCNC1=O

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 19/20 0.57
CYP3A4 P08684 2/20 0.43
CYP17A1 P05093 1/20 0.43
CYP11A1 P05108 1/20 0.43
TBXAS1 P24557 1/20 0.43
PMP22 Q01453 1/20 0.43
PDE4D Q08499 1/20 0.43
PDE3A Q14432 1/20 0.43
NFKB1 P19838 1/20 0.43

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
SCHEMBL31455435 0.85 CYP19A1 (0.61) CYP19A1CYP3A4CYP17A1CYP11A1TBXAS1
SCHEMBL27229513 0.81 GRIN1 (0.49) CYP19A1PMP22
SCHEMBL22147812 0.81 GRIN1 (0.49) CYP19A1PMP22
SCHEMBL5586397 0.79 CYP19A1 (0.36) CYP19A1
SCHEMBL30683300 0.79 CYP19A1 (0.37) CYP19A1CYP3A4CYP17A1CYP11A1TBXAS1
SCHEMBL27035700 0.79 CYP19A1 (0.37) CYP19A1CYP3A4CYP17A1CYP11A1TBXAS1
SCHEMBL19585699 0.77 CYP19A1 (0.70) CYP19A1CYP3A4CYP17A1CYP11A1TBXAS1
SCHEMBL30955766 0.77 CYP19A1 (0.70) CYP19A1CYP3A4CYP17A1CYP11A1TBXAS1
SCHEMBL30828418 0.77 CYP19A1 (0.70) CYP19A1CYP3A4CYP17A1CYP11A1TBXAS1
SCHEMBL17054781 0.75 CYP19A1 (0.70) CYP19A1CYP3A4CYP17A1CYP11A1TBXAS1

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
EP-4558485-A1 TEAD INHIBITORS AND METHODS OF USE Sporos Biodiscovery, Inc. (US) 2025-05-28 EP disclosed
CN-119497708-A TEAD inhibitors and methods of use 思博睿生物探索公司 2025-02-21 CN disclosed
WO-2024020350-A1 TEAD INHIBITORS AND METHODS OF USE SPOROS BIODISCOVERY, INC. (US) 2024-01-25 WO disclosed