SCHEMBL14115019

SCHEMBL14115019

COC(=O)c1cc2cc(Cl)cc(C)c2[nH]1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
XDH P47989 3/20 0.56
HRH4 Q9H3N8 7/20 0.56
SYK P43405 1/20 0.44
CYP1A2 P05177 1/20 0.42
ABL1 P00519 2/20 0.42
SRC P12931 2/20 0.42
MAPT P10636 1/20 0.41
USP2 O75604 1/20 0.40
ALDH1A1 P00352 1/20 0.40
ALOX15 P16050 1/20 0.40
GLA P06280 1/20 0.40
GAA P10253 1/20 0.40
KDM4E B2RXH2 1/20 0.39

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
SCHEMBL2452663 0.85 ALOX15 (0.58) HRH4MAPTALDH1A1ALOX15GLA
SCHEMBL16235908 0.83 HRH4 (0.56) XDHHRH4CYP1A2MAPT
SCHEMBL22396281 0.82 HRH4 (0.59) HRH4USP2ALDH1A1KDM4E
SCHEMBL14115024 0.81 XDH (0.56) XDHSYKCYP1A2MAPTALDH1A1
SCHEMBL14127307 0.81 CNR2 (0.46) HRH4ABL1MAPTUSP2ALDH1A1
SCHEMBL1277485 0.79 XDH (0.63) XDHHRH4MAPT
SCHEMBL3258615 0.76 XDH (0.45) XDHHRH4SYKCYP1A2ABL1
SCHEMBL3283667 0.76 NSD2 (0.61) XDHHRH4ABL1SRCALDH1A1
SCHEMBL20605176 0.75 XDH (0.68) XDHHRH4SYKCYP1A2MAPT
SCHEMBL3963537 0.73 F7 (0.66) XDHHRH4ALOX15

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-20080167476-A1 Process for the preparation of 2-substituted-7-Boryl indoles and compounds BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2008-07-10 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-20080167476-A1 Process for the preparation of 2-substituted-7-Boryl indoles and compounds INMT, IDO2, IDO1 XDH 1998/4885HRH4 3805/4885SYK 2318/4885

“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.