SCHEMBL5533932

SCHEMBL5533932

CN(C(=O)Nc1cc(C(F)(F)F)ccc1F)C1CCCCC1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 3/20 0.65
▸ POLB P06746 1/20 0.65
▸ KMT2A Q03164 2/20 0.63
▸ MEN1 O00255 1/20 0.63
▸ TSHR P16473 1/20 0.63
▸ NPC1 O15118 1/20 0.55
▸ ABCC1 P33527 2/20 0.52
▸ ATM Q13315 1/20 0.51
▸ DGAT1 O75907 1/20 0.47
▸ UBE2M P61081 1/20 0.46
▸ DCUN1D1 Q96GG9 1/20 0.46
▸ TMPRSS4 Q9NRS4 1/20 0.45
▸ CA12 O43570 1/20 0.43
▸ CA1 P00915 1/20 0.43
▸ CA2 P00918 1/20 0.43
▸ CA9 Q16790 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ KCNH2 Q12809 1/20 0.43
▸ USP30 Q70CQ3 2/20 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
SCHEMBL27264919 0.79 HTT (0.64) RAB9APOLBKMT2ANPC1ABCC1
SCHEMBL5534327 0.78 RAB9A (0.65) RAB9APOLBKMT2ANPC1ABCC1
SCHEMBL18615457 0.77 EPHX2 (0.63) RAB9APOLBKMT2AMEN1TSHR
SCHEMBL5533077 0.76 RAB9A (0.70) RAB9APOLBKMT2ANPC1ABCC1
SCHEMBL5531644 0.75 EPHX2 (0.62) RAB9APOLBKMT2AMEN1NPC1
SCHEMBL5531779 0.74 PDK2 (0.53) RAB9APOLBKMT2AMEN1TSHR
SCHEMBL12126017 0.73 MEN1 (0.60) KMT2AMEN1TSHRATMTMPRSS4
SCHEMBL30977684 0.73 MEN1 (0.60) KMT2AMEN1TSHRATMTMPRSS4
SCHEMBL12518235 0.73 ALDH1A1 (0.56) KMT2AMEN1TSHRTMPRSS4CA12
SCHEMBL3618813 0.72 MEN1 (0.61) KMT2AMEN1TSHRDGAT1TMPRSS4

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-20070010671-A1 Novel quinazoline derivatives and methods of treatment related to the use thereof ARENA PHARMACEUTICALS, INC. 2007-01-11 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070010671-A1 Novel quinazoline derivatives and methods of treatment related to the use thereof MCHR1, GPR119, MCHR2 RAB9A 902/4885POLB 4518/4885KMT2A 792/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

Send feedback