SCHEMBL21363517

SCHEMBL21363517

C[C@@H]1CO[C@@H](c2ccc(Cl)cc2)C1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.41
TSHR P16473 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
TAAR1 Q96RJ0 1/20 0.36
MAPK1 P28482 1/20 0.36
DRD2 P14416 1/20 0.35
TRPA1 O75762 4/20 0.35
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
HTR2B P41595 1/20 0.34
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
KMT2A Q03164 1/20 0.34
GSTO1 P78417 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
SCHEMBL17172100 1.00 CHRNA7 (0.41) CHRNA7TSHRSLC6A2SLC6A4SLC6A3
SCHEMBL21363398 1.00 CHRNA7 (0.41) CHRNA7TSHRSLC6A2SLC6A4SLC6A3
SCHEMBL17172116 0.83 SLC6A2 (0.45) CHRNA7TSHRSLC6A2SLC6A4SLC6A3
SCHEMBL1022637 0.81 TSHR (0.56) CHRNA7TSHRSLC6A2SLC6A4SLC6A3
SCHEMBL531416 0.81 TSHR (0.56) CHRNA7TSHRSLC6A2SLC6A4SLC6A3
SCHEMBL1583198 0.81 TSHR (0.56) CHRNA7TSHRSLC6A2SLC6A4SLC6A3
SCHEMBL21393372 0.81 KDM1A (0.39) TSHRSLC6A2SLC6A4SLC6A3TRPA1
SCHEMBL21363715 0.81 KDM1A (0.39) TSHRSLC6A2SLC6A4SLC6A3TRPA1
SCHEMBL17150950 0.80 TSHR (0.64) TSHRSLC6A2SLC6A3HTR2BMEN1
SCHEMBL17158448 0.77 TSHR (0.39) CHRNA7TSHRSLC6A2SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11655245-B2 Oxadiazole transient receptor potential channel inhibitors GENENTECH, INC. (US) 2023-05-23 US disclosed
US-20230121700-A1 OXADIAZOLE TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS GENENTECH, INC. (US) 2023-04-20 US disclosed
US-20200308161-A1 OXADIAZOLE TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS GENENTECH, INC. (US) 2020-10-01 US disclosed
US-10710994-B2 Oxadiazole transient receptor potential channel inhibitors GENENTECH, INC. (US) 2020-07-14 US disclosed
WO-2019182925-A1 OXADIAZOLE TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS GENENTECH, INC. (US) 2019-09-26 WO disclosed
US-20190284179-A1 OXADIAZOLE TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS GENENTECH, INC. (US) 2019-09-19 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 (5 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-11655245-B2 Oxadiazole transient receptor potential channel inhibitors TRPA1, TRPV1, P2RX3 CHRNA7 494/4885TSHR 1061/4885SLC6A2 1407/4885
US-20190284179-A1 OXADIAZOLE TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS TRPA1, TRPV1, TRPV3 CHRNA7 464/4885TSHR 903/4885SLC6A2 1619/4885
US-20200308161-A1 OXADIAZOLE TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS TRPA1, TRPV1, P2RX3 CHRNA7 494/4885TSHR 1061/4885SLC6A2 1407/4885
US-10710994-B2 Oxadiazole transient receptor potential channel inhibitors TRPA1, TRPV1, TRPV3 CHRNA7 464/4885TSHR 903/4885SLC6A2 1619/4885
US-20230121700-A1 OXADIAZOLE TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS TRPA1, TRPV1, TRPV3 CHRNA7 464/4885TSHR 903/4885SLC6A2 1619/4885

“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.