SCHEMBL3914641

SCHEMBL3914641

CCOC(=O)CC1CN(C(=O)O)CCN1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.38
POLB P06746 3/20 0.38
REN P00797 1/20 0.35
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 5/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
CYP1A2 P05177 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GAA P10253 2/20 0.33
MGAM O43451 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
RAB9A P51151 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
SCHEMBL21315834 1.00 TSHR (0.38) TSHRPOLBRENKMT2AALDH1A1
SCHEMBL21315838 1.00 TSHR (0.38) TSHRPOLBRENKMT2AALDH1A1
SCHEMBL20141289 0.85 REN (0.42) RENKMT2ALMNA
SCHEMBL900236 0.85 REN (0.42) RENKMT2ALMNA
SCHEMBL28879462 0.82 ALDH1A1 (0.39) TSHRPOLBKMT2AALDH1A1MAPT
SCHEMBL29713922 0.82 ALDH1A1 (0.39) TSHRPOLBKMT2AALDH1A1MAPT
SCHEMBL21315839 0.82 ALDH1A1 (0.39) TSHRPOLBKMT2AALDH1A1MAPT
SCHEMBL2919417 0.82 POLB (0.39) TSHRPOLBKMT2AALDH1A1LMNA
SCHEMBL16178360 0.79 PARP1 (0.43) RENMAPT
SCHEMBL18788447 0.79 PARP1 (0.43) RENMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240216361-A1 ROR-GAMMA MODULATORS ESCALIER BIOSCIENCES B V (US) 2024-07-04 US disclosed
US-20230277527-A1 ROR-GAMMA MODULATORS ESCALIER BIOSCIENCES B.V. 2023-09-07 US disclosed
WO-2022166749-A1 TRIHETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF 上海湃隆生物科技有限公司 2022-08-11 WO disclosed
EP-3532062-B1 ROR-GAMMA MODULATORS ESCALIER BIOSCIENCES BV (US) 2022-07-20 EP disclosed
US-20220175765-A1 ROR-GAMMA MODULATORS ESCALIER BIOSCIENCES B.V. 2022-06-09 US disclosed
US-20210069182-A1 ROR-GAMMA MODULATORS ESCALIER BIOSCIENCES B.V. 2021-03-11 US disclosed
US-10905687-B2 Substituted piperazines as ROR-gamma modulators ESCALIER BIOSCIENCES B.V. (US) 2021-02-02 US disclosed
US-20190269674-A1 ROR-GAMMA MODULATORS ESCALIER BIOSCIENCES, BV (US) 2019-09-05 US disclosed
US-7534887-B2 Thiazoline derivative and use of the same TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-05-19 US disclosed
US-20070010528-A1 Thiazoline derivative and use of the same TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-01-11 US disclosed
EP-1669352-A1 THIAZOLINE DERIVATIVE AND USE OF THE SAME Takeda Pharmaceutical Company Limited (JP) 2006-06-14 EP 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-20070010528-A1 Thiazoline derivative and use of the same TBXA2R, F2, F3 TSHR 12/4885POLB 3180/4885REN 1269/4885
US-20230277527-A1 ROR-GAMMA MODULATORS RORB, RORC, RORA TSHR 588/4885POLB 2301/4885REN 2718/4885
US-20240216361-A1 ROR-GAMMA MODULATORS RORB, RORC, RORA TSHR 588/4885POLB 2301/4885REN 2718/4885
US-20210069182-A1 ROR-GAMMA MODULATORS RORB, RORC, RORA TSHR 588/4885POLB 2301/4885REN 2718/4885
US-10905687-B2 Substituted piperazines as ROR-gamma modulators RORC, RORA, RORB TSHR 544/4885POLB 1965/4885REN 1400/4885
US-20220175765-A1 ROR-GAMMA MODULATORS RORB, RORC, RORA TSHR 588/4885POLB 2301/4885REN 2718/4885
US-20190269674-A1 ROR-GAMMA MODULATORS RORB, RORC, RORA TSHR 588/4885POLB 2301/4885REN 2718/4885

“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.