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SCHEMBL30847768

SCHEMBL30847768

Cc1cc(N(C)C(=O)Oc2c(N3CCNC3=O)cc(C(F)(F)F)cc2C(F)(F)F)ccc1F

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ POLQ O75417 10/20 0.40
▸ CMA1 P23946 7/20 0.34
▸ TACR1 P25103 1/20 0.32
▸ CRHR1 P34998 1/20 0.32
▸ LIPE Q05469 1/20 0.31

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
SCHEMBL30847728 0.90 POLQ (0.42) POLQCMA1TACR1LIPE
SCHEMBL30847628 0.86 POLQ (0.44) POLQCRHR1LIPE
SCHEMBL30847696 0.85 POLQ (0.36) POLQTACR1LIPE
SCHEMBL30847649 0.84 CMA1 (0.35) POLQCMA1CRHR1
SCHEMBL30847635 0.84 CMA1 (0.35) POLQCMA1CRHR1
SCHEMBL30847750 0.83 LIPE (0.34) POLQCMA1LIPE
SCHEMBL30847639 0.83 POLQ (0.41) POLQCMA1CRHR1
SCHEMBL30847821 0.81 POLQ (0.39) POLQCMA1CRHR1
SCHEMBL30847699 0.81 TACR3 (0.34) POLQCMA1TACR1
SCHEMBL30847823 0.79 TACR1 (0.43) POLQCMA1TACR1

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
EP-4598901-A1 PYRROLIDINE AND IMIDAZOLIDINE BASED DNA POLYMERASE THETA INHIBITORS AND USE THEREOF Thomas Jefferson University (US) 2025-08-13 — — EP disclosed
WO-2024076964-A1 PYRROLIDINE AND IMIDAZOLIDINE BASED DNA POLYMERASE THETA INHIBITORS AND USE THEREOF THOMAS JEFFERSON UNIVERSITY (US) 2024-04-11 — — WO disclosed