SCHEMBL11560867

SCHEMBL11560867

O=C(Nc1nnn[nH]1)c1cccc(Cl)c1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 1/20 0.50
▸ PLAU P00749 2/20 0.47
▸ PLAT P00750 2/20 0.47
▸ P2RX1 P51575 2/20 0.47
▸ F2 P00734 2/20 0.47
▸ F10 P00742 1/20 0.47
▸ P2RX4 Q99571 1/20 0.47
▸ P2RX7 Q99572 1/20 0.47
▸ TMPRSS4 Q9NRS4 1/20 0.47
▸ KDR P35968 1/20 0.46
▸ ALOX15 P16050 1/20 0.44
▸ JAK2 O60674 2/20 0.43
▸ TYK2 P29597 1/20 0.41
▸ KLK1 P06870 1/20 0.41
▸ KLK5 Q9Y337 1/20 0.41
▸ PARG Q86W56 1/20 0.40
▸ POLB P06746 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ MAPT P10636 1/20 0.39
▸ KMT2A Q03164 1/20 0.39

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
SCHEMBL12892210 0.87 JAK2 (0.55) F2KDRJAK2TYK2POLB
SCHEMBL11556569 0.84 KDM4E (0.40) ALOX15POLBHPGDMAPTKMT2A
SCHEMBL12310841 0.83 MMP2 (0.45) KLKB1KDRPOLBHPGDKMT2A
SCHEMBL11559144 0.83 HSPD1 (0.40) F2POLBHPGDMAPTKMT2A
SCHEMBL11557699 0.83 TERT (0.40) KLKB1PLAUPLATP2RX1F2
SCHEMBL11559491 0.83 KDR (0.51) PLAUPLATP2RX1F2F10
SCHEMBL11559540 0.81 ERN1 (0.38) KLKB1KDRJAK2POLBKMT2A
SCHEMBL11560143 0.81 MAPT (0.40) P2RX1KDRPOLBMAPTKMT2A
SCHEMBL11562445 0.80 RAB9A (0.45) HPGDMAPTKMT2ASMN1; SMN2
SCHEMBL11559525 0.80 CXCR2 (0.39) POLBMAPTKMT2AKDM4EALPL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4146631-A ANTIALLERGENS, RESPIRATORY DISORDERS MAY & BAKER LIMITED (GB) 1979-03-27 — — US disclosed
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