SCHEMBL15422672

SCHEMBL15422672

NN(c1ccc(Cl)cc1)c1ccccc1Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.36
LMNA P02545 3/20 0.36
CYP1A2 P05177 1/20 0.34
MAPT P10636 3/20 0.33
AOC3 Q16853 3/20 0.33
IDO1 P14902 1/20 0.33
CYP2A6 P11509 1/20 0.33
ALDH1A1 P00352 2/20 0.33
RAB9A P51151 2/20 0.33
NPC1 O15118 1/20 0.33
ALOX15 P16050 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HSD17B10 Q99714 1/20 0.33
HIF1A Q16665 2/20 0.32
CYP2C19 P33261 2/20 0.32
CYP3A4 P08684 2/20 0.32
CYP2C9 P11712 1/20 0.32
KDM4E B2RXH2 1/20 0.32
NR1I2 O75469 1/20 0.32
ABCB11 O95342 1/20 0.32

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
SCHEMBL11682887 0.87 TSHR (0.39) TSHRLMNACYP1A2MAPTAOC3
SCHEMBL11447749 0.82 TSHR (0.47) TSHRLMNACYP1A2AOC3IDO1
SCHEMBL7643192 0.78 TSHR (0.48) TSHRLMNACYP1A2MAPTIDO1
SCHEMBL27968952 0.73 TSHR (0.43) TSHRLMNACYP1A2MAPTAOC3
SCHEMBL29049714 0.72 TSHR (0.47) TSHRLMNACYP1A2AOC3IDO1
SCHEMBL6230596 0.71 HSD17B10 (0.34) TSHRLMNACYP1A2MAPTIDO1
SCHEMBL9249966 0.69 CYP1A2 (0.48) TSHRLMNACYP1A2MAPTCYP2A6
SCHEMBL9160441 0.69 CYP1A2 (0.48) TSHRLMNACYP1A2MAPTCYP2A6
SCHEMBL28566057 0.69 AOC3 (0.46) TSHRLMNAAOC3ALDH1A1SLC6A2
1,4-Dichlorobenzene SCHEMBL1155125 0.68 TSHR (0.77) TSHRLMNACYP1A2MAPTIDO1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9051314-B2 Bridged heterocyclic compounds and methods of use MEDIVATION TECHNOLOGIES, INC. (US) 2015-06-09 US disclosed
US-20140024643-A1 BRIDGED HETEROCYCLIC COMPOUNDS AND METHODS OF USE MEDIVATION TECHNOLOGIES, INC. (US) 2014-01-23 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-20140024643-A1 BRIDGED HETEROCYCLIC COMPOUNDS AND METHODS OF USE HRH4, HNMT, HTR2C TSHR 961/4885LMNA 4766/4885CYP1A2 1325/4885

“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.