SCHEMBL17239587

SCHEMBL17239587

Cc1cc(Cl)c(C(=O)O)cc1B1OC(C)(C)C(C)(C)O1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.35
ALDH1A1 P00352 2/20 0.35
TP53 P04637 1/20 0.35
CASP1 P29466 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MYC P01106 2/20 0.35
NR4A1 P22736 1/20 0.35
CTSB P07858 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA3 P07451 1/20 0.34
CA4 P22748 1/20 0.34
CA6 P23280 1/20 0.34
CA5A P35218 1/20 0.34
CA7 P43166 1/20 0.34
CA9 Q16790 1/20 0.34
CA13 Q8N1Q1 1/20 0.34
CISD1 Q9NZ45 1/20 0.34

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
SCHEMBL12942090 0.86 GABRP (0.34) ALDH1A1MYCNOTUMRXRA
SCHEMBL17239603 0.84 MEN1 (0.38) TSHRALDH1A1TP53SMN1; SMN2LMNA
SCHEMBL10059293 0.83 KDM4E (0.35) ALDH1A1MYCNOTUMRXRA
SCHEMBL17873998 0.82 RXRA (0.35) JAK2BTKNOTUMRXRA
SCHEMBL18107884 0.80 LIPG (0.36) TDP1CA12CA1CA2CA3
SCHEMBL29476998 0.79 HPGD (0.49) TSHRSMN1; SMN2CA12CA1CA2
SCHEMBL10059440 0.79 RXRA (0.35) JAK2BTKNOTUMRXRA
SCHEMBL17939909 0.79 LIPG (0.36) TSHRALDH1A1TP53CASP1SMN1; SMN2
SCHEMBL17752342 0.79 JAK2 (0.34) JAK2BTK
SCHEMBL16599583 0.76 KDM4E (0.36) TDP1JAK2BTK

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-9328096-B2 Tropomyosin-related kinase inhibitors PFIZER INC. (US) 2016-05-03 US disclosed
US-20150322043-A1 TROPOMYOSIN-RELATED KINASE INHIBITORS PFIZER (US) 2015-11-12 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-20150322043-A1 TROPOMYOSIN-RELATED KINASE INHIBITORS TPM3, MUSK, TPM4 TSHR 611/4885ALDH1A1 1891/4885TP53 919/4885

“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.