SCHEMBL21186463

SCHEMBL21186463

CC(C)CS(C)(C)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PSIP1 O75475 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ LARS1 Q9P2J5 1/20 0.35
▸ HTR6 P50406 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ TAAR1 Q96RJ0 4/20 0.33
▸ SLC6A2 P23975 2/20 0.33
▸ MAOA P21397 1/20 0.33
▸ SLC6A4 P31645 1/20 0.33
▸ SLC6A3 Q01959 1/20 0.33
▸ SIGMAR1 Q99720 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ CYP2A6 P11509 1/20 0.33
▸ ADORA2A P29274 1/20 0.33
▸ ADORA1 P30542 1/20 0.33
▸ GAA P10253 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
SCHEMBL17987622 0.79 HTR2A (0.41) PSIP1CYP1A2CYP2C19TAAR1SLC6A2
SCHEMBL25083084 0.78 PSIP1 (0.41) PSIP1SMN1; SMN2LARS1HTR6ALDH1A1
SCHEMBL136456 0.78 PSIP1 (0.41) PSIP1SMN1; SMN2LARS1HTR6ALDH1A1
SCHEMBL372611 0.78 PSIP1 (0.41) PSIP1SMN1; SMN2LARS1HTR6ALDH1A1
SCHEMBL778303 0.74 PSIP1 (0.60) PSIP1SMN1; SMN2LARS1HTR6ALDH1A1
SCHEMBL19561677 0.72 PSIP1 (0.56) PSIP1SMN1; SMN2HTR6ALDH1A1KDM4E
SCHEMBL21186486 0.71 PSIP1 (0.39) PSIP1HTR6ALDH1A1CYP2C19RAB9A
SCHEMBL21656681 0.70 PSIP1 (0.42) PSIP1SMN1; SMN2HTR6ALDH1A1KDM4E
SCHEMBL21186465 0.70 PSIP1 (0.42) PSIP1SMN1; SMN2HTR6ALDH1A1KDM4E
SCHEMBL20388830 0.70 PSIP1 (0.42) PSIP1SMN1; SMN2HTR6ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190225629-A1 METHOD FOR PREPARING SILAHYDROCARBONS UNIVERSITY OF DELAWARE (US) 2019-07-25 — — 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-20190225629-A1 METHOD FOR PREPARING SILAHYDROCARBONS MCM6, CCNY, RIOX2 PSIP1 3560/4885SMN1; SMN2 1069/4885LARS1 2645/4885

“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.

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