SCHEMBL10467043

SCHEMBL10467043

OC(CBr)c1ccc2nc[nH]c2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRKCI P41743 1/20 0.46
▸ KDM4E B2RXH2 2/20 0.45
▸ MAPT P10636 1/20 0.45
▸ RAD52 P43351 1/20 0.45
▸ MMP12 P39900 1/20 0.42
▸ HDAC6 Q9UBN7 1/20 0.42
▸ CYP3A4 P08684 2/20 0.41
▸ CYP26A1 O43174 2/20 0.41
▸ CYP2C8 P10632 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ CYP19A1 P11511 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CYP24A1 Q07973 1/20 0.41
▸ CYP26B1 Q9NR63 1/20 0.41
▸ NAMPT P43490 1/20 0.41
▸ XDH P47989 1/20 0.41
▸ CTNNB1 P35222 1/20 0.41
▸ WNT3A P56704 1/20 0.41
▸ QPCT Q16769 6/20 0.41
▸ HTT P42858 2/20 0.41

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
SCHEMBL10467041 0.87 MAPT (0.37) PRKCIKDM4EMAPTRAD52MMP12
SCHEMBL10467019 0.85 PRKCI (0.51) PRKCIKDM4EMAPTRAD52MMP12
SCHEMBL10465746 0.84 PRKCI (0.46) PRKCIKDM4EMAPTRAD52MMP12
SCHEMBL23655003 0.81 PRKCI (0.53) PRKCIKDM4EMAPTRAD52MMP12
SCHEMBL24630978 0.78 ADRB2 (0.52) KDM4EMAPTCYP3A4CYP2D6ALDH1A1
SCHEMBL11476242 0.78 ADRB2 (0.52) KDM4EMAPTCYP3A4CYP2D6ALDH1A1
SCHEMBL22864145 0.77 HTT (0.46) PRKCIKDM4EMAPTRAD52MMP12
SCHEMBL24631003 0.75 EPHX1 (0.49) PRKCIKDM4EHDAC6CYP26A1QPCT
SCHEMBL8013060 0.74 PRKCI (0.53) PRKCIKDM4EMAPTRAD52MMP12
SCHEMBL24631002 0.74 HTT (0.41) PRKCIKDM4EMAPTRAD52CYP2D6

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-4960783-A ANIMAL GROWTH REGULATORS BAYER AKTIENGESELLSCHAFT (DE) 1990-10-02 — — US disclosed
Send feedback