SCHEMBL31747413

SCHEMBL31747413

C#CCCCc1ccc(C(=O)O)cn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P4HA1 P13674 2/20 0.44
▸ P4HTM Q9NXG6 2/20 0.44
▸ MIF P14174 1/20 0.43
▸ GABRP O00591 1/20 0.42
▸ GABRD O14764 1/20 0.42
▸ GABRA1 P14867 1/20 0.42
▸ GABRB1 P18505 1/20 0.42
▸ GABRG2 P18507 1/20 0.42
▸ GABRB3 P28472 1/20 0.42
▸ GABRA5 P31644 1/20 0.42
▸ GABRA3 P34903 1/20 0.42
▸ GABRA2 P47869 1/20 0.42
▸ GABRB2 P47870 1/20 0.42
▸ GABRA4 P48169 1/20 0.42
▸ GABRE P78334 1/20 0.42
▸ GABRA6 Q16445 1/20 0.42
▸ GABRG1 Q8N1C3 1/20 0.42
▸ GABRG3 Q99928 1/20 0.42
▸ GABRQ Q9UN88 1/20 0.42
▸ NAPRT Q6XQN6 1/20 0.42

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
SCHEMBL31747395 0.95 P4HA1 (0.43) P4HA1P4HTMMIFGABRPGABRD
SCHEMBL31747260 0.86 NNMT (0.45) GABRA5CYP1A2CYP2C19SMN1; SMN2L3MBTL1
SCHEMBL31747492 0.82 MAPK1 (0.49) ALDH1A1MAPTL3MBTL1
SCHEMBL31747380 0.82 NNMT (0.44) MIFGABRA5SMN1; SMN2L3MBTL1
SCHEMBL20046092 0.80 P4HA1 (0.50) P4HA1P4HTMMIFGABRPGABRD
SCHEMBL20423258 0.79 P4HA1 (0.48) P4HA1P4HTMMIFGABRPGABRD
SCHEMBL28210133 0.79 P4HA1 (0.48) P4HA1P4HTMMIFGABRPGABRD
SCHEMBL10663641 0.79 HCAR3 (0.56) P4HA1P4HTMMIFCYP1A2ALDH1A1
SCHEMBL31747479 0.79 MAPK1 (0.48) ALDH1A1MAPTSMN1; SMN2L3MBTL1
SCHEMBL10663476 0.78 HCAR3 (0.57) ALDH1A1HCAR3MAPTSMN1; SMN2

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
WO-2025262297-A1 PROTAC DEGRADERS OF MLLT1 AND/OR MLLT3 DARK BLUE THERAPEUTICS LTD (GB) 2025-12-26 — — WO disclosed
EP-4667467-A1 PROTAC DEGRADERS OF MLLT1 AND/OR MLLT3 Dark Blue Therapeutics Ltd (GB) 2025-12-24 — — EP disclosed
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