SCHEMBL17396368

SCHEMBL17396368

O[C@H](CS)C(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CPA3 P15088 1/20 0.39
FOLH1 Q04609 1/20 0.39
GRIN1 Q05586 4/20 0.36
GRIN2A Q12879 4/20 0.36
GRIN2D O15399 3/20 0.36
GRIN2C Q14957 3/20 0.36
GRIN2B Q13224 2/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
ANPEP P15144 1/20 0.34
IDO1 P14902 1/20 0.33
KCNN4 O15554 1/20 0.33

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
SCHEMBL14937220 0.84 KIF11 (0.46)
SCHEMBL10770500 0.83 MEN1 (0.38) CPA3FOLH1GRIN1GRIN2AGRIN2D
SCHEMBL14746124 0.80 KIF11 (0.32) CPA3FOLH1
SCHEMBL11856881 0.78 CYP2C19 (0.39) GRIN1GRIN2AGRIN2DGRIN2CGRIN2B
SCHEMBL14937219 0.78 HTT (0.39) CYP1A2
SCHEMBL6655136 0.77 TAAR1 (0.41) KCNN4
SCHEMBL14490195 0.77 CYP2C19 (0.36) CPA3FOLH1GRIN1GRIN2AGRIN2D
SCHEMBL34050 0.77 FOLH1 (0.43) FOLH1CYP2C19
SCHEMBL34051 0.77 FOLH1 (0.43) FOLH1CYP2C19
SCHEMBL8659893 0.76 TRPA1 (0.37) GRIN1GRIN2AGRIN2DGRIN2CGRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11458206-B2 Targeted conjugates and particles and formulations thereof TVA (ABC), LLC (US) 2022-10-04 US disclosed
US-20200206356-A1 TARGETED CONJUGATES AND PARTICLES AND FORMULATIONS THEREOF TVA (ABC), LLC 2020-07-02 US disclosed
US-10624967-B2 Targeted conjugates and particles and formulations thereof TARVEDA THERAPEUTICS, INC. (US) 2020-04-21 US disclosed
US-10322191-B2 Targeted conjugates and particles and formulations thereof TARVEDA THERAPEUTICS, INC. (US) 2019-06-18 US disclosed
US-20180000959-A1 TARGETED CONJUGATES AND PARTICLES AND FORMULATIONS THEREOF TVA (ABC), LLC 2018-01-04 US disclosed
US-20170312245-A1 TARGETED CONJUGATES AND PARTICLES AND FORMULATIONS THEREOF TVA (ABC), LLC 2017-11-02 US disclosed
US-9750818-B2 Targeted conjugates and particles and formulations thereof TARVEDA THERAPEUTICS, INC. (US) 2017-09-05 US disclosed
EP-3160518-A2 TARGETED CONJUGATES AND PARTICLES AND FORMULATIONS THEREOF Tarveda Therapeutics, Inc. (US) 2017-05-03 EP disclosed
US-20170095569-A1 TARGETED CONJUGATES AND PARTICLES AND FORMULATIONS THEREOF TVA (ABC), LLC 2017-04-06 US disclosed
WO-2016004048-A2 TARGETED CONJUGATES AND PARTICLES AND FORMULATIONS THEREOF BLEND THERAPEUTICS, INC. (US) 2016-01-07 WO 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 (7 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-20180000959-A1 TARGETED CONJUGATES AND PARTICLES AND FORMULATIONS THEREOF SSTR5, SSTR1, SSTR4 CPA3 48/4885FOLH1 54/4885GRIN1 2518/4885
US-10624967-B2 Targeted conjugates and particles and formulations thereof SSTR5, SSTR1, SSTR4 CPA3 48/4885FOLH1 54/4885GRIN1 2518/4885
US-20200206356-A1 TARGETED CONJUGATES AND PARTICLES AND FORMULATIONS THEREOF SSTR5, SSTR1, SSTR4 CPA3 48/4885FOLH1 54/4885GRIN1 2518/4885
US-20170095569-A1 TARGETED CONJUGATES AND PARTICLES AND FORMULATIONS THEREOF SSTR5, SSTR1, SSTR4 CPA3 48/4885FOLH1 54/4885GRIN1 2518/4885
US-10322191-B2 Targeted conjugates and particles and formulations thereof SSTR5, SSTR1, SSTR4 CPA3 48/4885FOLH1 54/4885GRIN1 2518/4885
US-11458206-B2 Targeted conjugates and particles and formulations thereof SSTR5, SSTR1, SSTR4 CPA3 48/4885FOLH1 54/4885GRIN1 2518/4885
US-20170312245-A1 TARGETED CONJUGATES AND PARTICLES AND FORMULATIONS THEREOF SSTR5, SSTR1, SSTR4 CPA3 48/4885FOLH1 54/4885GRIN1 2518/4885

“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.