SCHEMBL5574769

SCHEMBL5574769

O=C(CCl)NCCc1ccc(Cl)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.66
CYP1A2 P05177 2/20 0.62
CYP2D6 P10635 2/20 0.62
CYP2C19 P33261 2/20 0.62
CNR1 P21554 1/20 0.62
TSHR P16473 1/20 0.60
HSD17B10 Q99714 1/20 0.60
L3MBTL1 Q9Y468 1/20 0.60
CA12 O43570 1/20 0.59
CA1 P00915 1/20 0.59
CA2 P00918 1/20 0.59
CA9 Q16790 1/20 0.59
GAA P10253 2/20 0.58
MAPT P10636 2/20 0.58
NPC1 O15118 1/20 0.58
RAB9A P51151 1/20 0.58
GFER P55789 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
TAAR1 Q96RJ0 1/20 0.58
IDO1 P14902 1/20 0.58

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
SCHEMBL5681870 0.87 CA12 (0.75) LMNACYP1A2CYP2D6CYP2C19CNR1
SCHEMBL4268220 0.85 LMNA (0.62) LMNACYP1A2CYP2D6CYP2C19CNR1
SCHEMBL2191045 0.85 KDM4E (0.65) LMNACYP1A2CYP2D6CYP2C19GAA
SCHEMBL9925290 0.83 HPGD (0.62) LMNACNR1NPC1RAB9ASMN1; SMN2
SCHEMBL3316967 0.83 HPGD (0.68) LMNACNR1TSHRCA12CA1
SCHEMBL2792326 0.83 HPGD (0.54) LMNACYP1A2CYP2D6CYP2C19HSD17B10
SCHEMBL6850677 0.83 ESRRG (0.53) LMNACA12CA1CA2CA9
SCHEMBL20052590 0.83 LMNA (0.47) LMNACYP1A2CYP2D6CYP2C19CNR1
SCHEMBL4582082 0.82 TAAR1 (0.65) LMNACYP1A2CYP2D6CYP2C19CNR1
SCHEMBL696928 0.82 HDAC3 (0.62) L3MBTL1CA12CA1CA2CA9

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
CN-100500665-C Triazolo-pyrimido-thioacetamide compounds, preparation method and uses UNIV ZHEJIANG TECHNOLOGY (CN) 2009-06-17 CN disclosed
US-20070293475-A1 ARYL AND HETEROARYL TETRAHYDROBENZAZEPINE DERIVATIVES AND THEIR USE FOR TREATING GLAUCOMA ALCON MANUFACTURING LTD. (US) 2007-12-20 US disclosed
US-20070293475-A1 ARYL AND HETEROARYL TETRAHYDROBENZAZEPINE DERIVATIVES AND THEIR USE FOR TREATING GLAUCOMA ALCON MANUFACTURING LTD. (US) 2007-12-20 US disclosed
US-20070293475-A1 ARYL AND HETEROARYL TETRAHYDROBENZAZEPINE DERIVATIVES AND THEIR USE FOR TREATING GLAUCOMA ALCON MANUFACTURING LTD. (US) 2007-12-20 US disclosed
CN-1962662-A Triazolo-pyrimido-thioacetamide compounds, preparation method and uses UNIV ZHEJIANG TECHNOLOGY (CN) 2007-05-16 CN 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-20070293475-A1 ARYL AND HETEROARYL TETRAHYDROBENZAZEPINE DERIVATIVES AND THEIR USE FOR TREATING GLAUCOMA HTR2B, HTR2A, HTR3B LMNA 2783/4885CYP1A2 147/4885CYP2D6 582/4885

“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.