SCHEMBL6720860

SCHEMBL6720860

O=C(O)c1cc(Cl)c(OCc2cccc(I)c2)c(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MRGPRX4 Q96LA9 14/20 0.56
▸ NPC1 O15118 2/20 0.52
▸ TP53 P04637 2/20 0.52
▸ XBP1 P17861 2/20 0.52
▸ RAB9A P51151 2/20 0.52
▸ SMN1; SMN2 Q16637 2/20 0.52
▸ MEN1 O00255 1/20 0.52
▸ MITF O75030 1/20 0.52
▸ HPGD P15428 1/20 0.52
▸ NFKB1 P19838 1/20 0.52
▸ NFKB2 Q00653 1/20 0.52
▸ KMT2A Q03164 1/20 0.52
▸ RELA Q04206 1/20 0.52
▸ RXRA P19793 1/20 0.50
▸ RXRB P28702 1/20 0.50
▸ RXRG P48443 1/20 0.50
▸ NR4A2 P43354 1/20 0.49
▸ PLAU P00749 1/20 0.49
▸ MAPT P10636 1/20 0.48
▸ HTT P42858 1/20 0.48

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
SCHEMBL4272964 0.86 THRA (0.52) MRGPRX4NPC1TP53XBP1RAB9A
SCHEMBL4265967 0.86 F2 (0.49) MRGPRX4TP53RAB9ASMN1; SMN2MEN1
SCHEMBL1457712 0.85 MEN1 (0.63) MRGPRX4NPC1TP53XBP1RAB9A
SCHEMBL22480969 0.80 NPC1 (0.74) MRGPRX4NPC1TP53XBP1RAB9A
SCHEMBL6725147 0.78 NR4A2 (0.62) MRGPRX4NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL6721220 0.78 RXRA (0.64) MRGPRX4NPC1TP53XBP1RAB9A
SCHEMBL4931492 0.77 THRA (0.46) MRGPRX4SMN1; SMN2MEN1HPGDKMT2A
SCHEMBL16351377 0.76 MRGPRX4 (0.68) MRGPRX4NPC1TP53XBP1RAB9A
SCHEMBL4901522 0.75 GLRA1 (0.65) MRGPRX4NPC1TP53XBP1RAB9A
SCHEMBL10323084 0.74 KDM4E (0.64) MRGPRX4NPC1TP53XBP1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6638977-B1 Biaryl and benzyl ethers and thioethers CORVAS INTERNATIONAL, INC. 2003-10-28 — — US claimed
WO-2001036351-A2 PLASMINOGEN ACTIVATOR INHIBITOR ANTAGONISTS RELATED APPLICATIONS CORVAS INTERNATIONAL, INC. (US) 2001-05-25 — — WO claimed
US-6677473-B1 TREATMENT, PREVENTION OR AMELIORATION OF ONE OR MORE SYMPTOMS OF THROMBOTIC DISORDERS, UNSTABLE ANGINA OR CANCER CORVAS INTERNATIONAL INC 2004-01-13 — — US disclosed
WO-2003009871-A2 INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR FOR DECREASING BODY MASS GENSET S.A. (FR) 2003-02-06 — — WO disclosed
WO-2001036351-A2 PLASMINOGEN ACTIVATOR INHIBITOR ANTAGONISTS RELATED APPLICATIONS CORVAS INTERNATIONAL, INC. (US) 2001-05-25 — — WO disclosed
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