SCHEMBL10161340

SCHEMBL10161340

Cc1cc2c(Br)cccc2c(OCc2ccccc2)c1C(=O)Oc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRA P10827 3/20 0.42
THRB P10828 3/20 0.42
MAOB P27338 2/20 0.41
USP2 O75604 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
HSD17B10 Q99714 1/20 0.41
PTPN1 P18031 1/20 0.40
MAPT P10636 3/20 0.40
TDP1 Q9NUW8 1/20 0.40
NR1H4 Q96RI1 1/20 0.40
LMNA P02545 1/20 0.40
HPGD P15428 1/20 0.40
NR4A2 P43354 1/20 0.40
TP53 P04637 1/20 0.39
SMPD1 P17405 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
PTGER1 P34995 1/20 0.38
PTGER4 P35408 1/20 0.38
PTGER3 P43115 1/20 0.38

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
SCHEMBL10161344 0.89 MAPT (0.51) THRATHRBUSP2ALDH1A1TSHR
SCHEMBL10161338 0.88 HPGD (0.46) MAOBUSP2ALDH1A1TSHRHSD17B10
SCHEMBL10161339 0.86 MRGPRX4 (0.46) MAOBUSP2ALDH1A1TSHRHSD17B10
SCHEMBL10196582 0.86 THRA (0.40) THRATHRBMAPTLMNA
SCHEMBL10160835 0.85 L3MBTL1 (0.41) ALDH1A1MAPTTDP1LMNAHPGD
SCHEMBL10161447 0.81 TP53 (0.43) THRATHRBMAOBPTPN1MAPT
SCHEMBL10160837 0.79 ELANE (0.36) HSD17B10MAPTTDP1LMNAHPGD
SCHEMBL10161372 0.79 BRD4 (0.40) USP2ALDH1A1TSHRHSD17B10MAPT
SCHEMBL10161437 0.79 MAPT (0.43) MAOBPTPN1MAPTTDP1LMNA
SCHEMBL17692779 0.75 PTGER1 (0.47) MAOBPTPN1LMNANR4A2SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120115819-A1 Pentacycline Compounds TETRAPHASE PHARMACEUTICALS, INC. 2012-05-10 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-20120115819-A1 Pentacycline Compounds TSLP, IL5, IL17A THRA 184/4885THRB 355/4885MAOB 2274/4885

“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.