SCHEMBL4558799

SCHEMBL4558799

CCc1cc(NC2CCCCC2)c(C)c(CC)c1NC1CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 4/20 0.40
HDAC8 Q9BY41 1/20 0.38
ALDH1A1 P00352 3/20 0.37
MAPT P10636 2/20 0.37
LMNA P02545 1/20 0.37
CRHBP P24387 1/20 0.37
CRHR2 Q13324 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
KMT2A Q03164 2/20 0.36
HPGD P15428 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA7 P43166 1/20 0.35
CA13 Q8N1Q1 1/20 0.35
YAP1 P46937 1/20 0.34
KDM4E B2RXH2 2/20 0.34
GAA P10253 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TSHR P16473 1/20 0.33

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
SCHEMBL4491577 0.82 KMT2A (0.40) ALOX15HDAC8ALDH1A1MAPTLMNA
SCHEMBL4493246 0.81 ALDH1A1 (0.39) ALOX15HDAC8ALDH1A1KMT2ACA12
SCHEMBL11847765 0.71 ALDH1A1 (0.46) ALOX15HDAC8ALDH1A1MAPTLMNA
SCHEMBL6884900 0.64 KMT2A (0.47) ALDH1A1LMNASMN1; SMN2KMT2AHPGD
SCHEMBL20353196 0.63 TAS1R3 (0.51) HDAC8ALDH1A1LMNASMN1; SMN2KMT2A
SCHEMBL13801654 0.63 KDM4E (0.58) HDAC8ALDH1A1MAPTLMNACRHBP
SCHEMBL2973035 0.63 ALOX15 (0.40) ALOX15HDAC8ALDH1A1MAPTLMNA
SCHEMBL13801653 0.63 PDE4A (0.41) ALOX15MAPTCA12CA1CA2
SCHEMBL18292041 0.62 CA1 (0.65) CA12CA1CA2CA7CA13
SCHEMBL18829768 0.62 HDAC8 (0.43) HDAC8ALDH1A1MAPTLMNACRHBP

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-20090156441-A1 Cycloalkyl phenylenediamines as deposit control agents for lubricants GREAT LAKES CHEMICAL GLOBAL, INC. 2009-06-18 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 (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-20090156441-A1 Cycloalkyl phenylenediamines as deposit control agents for lubricants C5, C9, C1S ALOX15 65/4885HDAC8 4804/4885ALDH1A1 1125/4885

“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.