SCHEMBL10192011

SCHEMBL10192011

CCCCOC(=O)Nc1cccc(C)c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.72
HPGD P15428 7/20 0.72
LMNA P02545 3/20 0.72
NPC1 O15118 7/20 0.71
SMN1; SMN2 Q16637 7/20 0.71
CYP1A2 P05177 3/20 0.71
CYP2C19 P33261 3/20 0.71
CYP2C9 P11712 2/20 0.71
EPHX2 P34913 1/20 0.58
ALDH1A1 P00352 3/20 0.56
MAPK1 P28482 3/20 0.56
L3MBTL1 Q9Y468 2/20 0.56
KDM4E B2RXH2 2/20 0.56
MAPT P10636 2/20 0.56
CASP1 P29466 1/20 0.56
MCL1 Q07820 1/20 0.56
ALOX15 P16050 1/20 0.55
TSHR P16473 1/20 0.55
HTT P42858 1/20 0.55
CASP3 P42574 1/20 0.54

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
SCHEMBL10191988 0.91 HPGD (0.71) RAB9AHPGDLMNANPC1SMN1; SMN2
SCHEMBL7565913 0.91 RAB9A (0.81) RAB9AHPGDLMNANPC1SMN1; SMN2
SCHEMBL13665249 0.90 RAB9A (0.78) RAB9AHPGDLMNANPC1SMN1; SMN2
SCHEMBL7565917 0.88 RAB9A (0.72) RAB9AHPGDLMNANPC1SMN1; SMN2
SCHEMBL10192012 0.87 HPGD (0.56) RAB9AHPGDLMNANPC1SMN1; SMN2
SCHEMBL12285188 0.87 RAB9A (0.74) RAB9AHPGDLMNANPC1SMN1; SMN2
SCHEMBL3424143 0.86 MAPK1 (0.69) RAB9AHPGDLMNANPC1SMN1; SMN2
SCHEMBL27422626 0.85 RAB9A (0.72) RAB9AHPGDLMNANPC1SMN1; SMN2
SCHEMBL27308926 0.84 RAB9A (0.61) RAB9AHPGDLMNANPC1SMN1; SMN2
SCHEMBL11218133 0.84 EPHX2 (0.79) RAB9AHPGDLMNANPC1SMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120009142-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2012-01-12 US disclosed
US-7973069-B2 Methods for treating hepatitis C PTC THERAPEUTICS, INC. (US) 2011-07-05 US disclosed
US-20100305100-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2010-12-02 US disclosed
US-20100292187-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2010-11-18 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 (3 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-20120009142-A1 METHODS FOR TREATING HEPATITIS C OAT, HAVCR2, HCCS RAB9A 3975/4885HPGD 1033/4885LMNA 3101/4885
US-20100292187-A1 METHODS FOR TREATING HEPATITIS C HAVCR2, EIF2AK2, MAVS RAB9A 2829/4885HPGD 3255/4885LMNA 1012/4885
US-20100305100-A1 METHODS FOR TREATING HEPATITIS C HAVCR2, EIF2AK2, MAVS RAB9A 2829/4885HPGD 3255/4885LMNA 1012/4885

“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.