SCHEMBL12767916

SCHEMBL12767916

CC(C)Nc1cc(Cl)cc(Cl)c1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 4/20 0.50
ALDH1A1 P00352 3/20 0.50
TSHR P16473 3/20 0.50
CYP3A4 P08684 2/20 0.50
RECQL P46063 2/20 0.50
HSPA5 P11021 1/20 0.44
GABRA1 P14867 1/20 0.42
GABRB1 P18505 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
HPGD P15428 2/20 0.41
ALOX15 P16050 2/20 0.41
ALOX12 P18054 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HIF1A Q16665 2/20 0.41
POLB P06746 2/20 0.41
TTR P02766 2/20 0.41
KDM4E B2RXH2 1/20 0.41
SLC22A2 O15244 1/20 0.41
SLC22A1 O15245 1/20 0.41

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
SCHEMBL11013255 0.77 HSD17B10 (0.56) HSD17B10ALDH1A1TSHRCYP3A4RECQL
SCHEMBL12846662 0.75 ALDH1A1 (0.44) HSD17B10ALDH1A1TSHRCYP3A4RECQL
SCHEMBL4968551 0.72 ALDH1A1 (0.41) HSD17B10ALDH1A1TSHRCYP3A4RECQL
SCHEMBL7201523 0.71 HSD17B10 (0.54) HSD17B10ALDH1A1TSHRCYP3A4RECQL
SCHEMBL2157691 0.71 CA1 (0.55) ALDH1A1TSHRHPGDSMN1; SMN2LMNA
SCHEMBL8359924 0.71 RAPGEF4 (0.47) HSD17B10ALDH1A1TSHRCYP3A4MEN1
SCHEMBL4968542 0.71 HSPA5 (0.50) HSD17B10ALDH1A1TSHRCYP3A4RECQL
SCHEMBL4968547 0.71 HSPA5 (0.50) HSD17B10ALDH1A1TSHRCYP3A4RECQL
SCHEMBL4968980 0.71 ALDH1A1 (0.39) HSD17B10ALDH1A1TSHRCYP3A4RECQL
SCHEMBL4970133 0.71 ALDH1A1 (0.39) HSD17B10ALDH1A1TSHRCYP3A4RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8962244-B2 Compounds for modulating RNA binding proteins and uses therefor UNIVERSITY OF MASSACHUSETTS (US) 2015-02-24 US disclosed
US-20130217685-A1 COMPOUNDS FOR MODULATING RNA BINDING PROTEINS AND USES THEREFOR UNIVERSITY OF MASSACHUSETTS (US) 2013-08-22 US disclosed
US-8377639-B2 Compounds for modulating RNA binding proteins and uses therefor UNIVERSITY OF MASSACHUSETTS (US) 2013-02-19 US disclosed
US-20110065704-A1 COMPOUNDS FOR MODULATING RNA BINDING PROTEINS AND USES THEREFOR NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2011-03-17 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 (2 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-20130217685-A1 COMPOUNDS FOR MODULATING RNA BINDING PROTEINS AND USES THEREFOR TIA1, ZFP3, RBM3 HSD17B10 4439/4885ALDH1A1 3135/4885TSHR 4273/4885
US-20110065704-A1 COMPOUNDS FOR MODULATING RNA BINDING PROTEINS AND USES THEREFOR TIA1, ZFP3, RBM3 HSD17B10 4439/4885ALDH1A1 3135/4885TSHR 4273/4885

“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.