SCHEMBL21895372

SCHEMBL21895372

O=C(OCc1ccc(F)cc1)C1CC2C=CC1C2

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.53
RAB9A P51151 1/20 0.53
HPGD P15428 1/20 0.51
KMT2A Q03164 3/20 0.50
POLB P06746 2/20 0.50
HSD17B10 Q99714 2/20 0.46
APEX1 P27695 1/20 0.46
RECQL P46063 1/20 0.46
BLM P54132 1/20 0.46
ESR2 Q92731 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
FABP7 O15540 1/20 0.45
FABP5 Q01469 1/20 0.45
LMNA P02545 2/20 0.41
KDM4E B2RXH2 2/20 0.41
MAPK1 P28482 2/20 0.39
MAPT P10636 1/20 0.39
MMP1 P03956 1/20 0.38
MMP2 P08253 1/20 0.38

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
SCHEMBL21895675 1.00 ALDH1A1 (0.53) ALDH1A1RAB9AHPGDKMT2APOLB
SCHEMBL21895373 0.87 ALDH1A1 (0.49) ALDH1A1RAB9AHPGDKMT2APOLB
SCHEMBL21895660 0.87 ALDH1A1 (0.53) ALDH1A1RAB9AHPGDKMT2APOLB
SCHEMBL2994567 0.87 ALDH1A1 (0.64) ALDH1A1RAB9AHPGDKMT2APOLB
SCHEMBL10532151 0.87 ALDH1A1 (0.64) ALDH1A1RAB9AHPGDKMT2APOLB
SCHEMBL21895371 0.87 ALDH1A1 (0.47) ALDH1A1RAB9AHPGDKMT2APOLB
SCHEMBL21840068 0.87 ALDH1A1 (0.52) ALDH1A1RAB9AHPGDKMT2APOLB
SCHEMBL3294863 0.86 ALDH1A1 (0.49) ALDH1A1RAB9AHPGDKMT2APOLB
SCHEMBL21895379 0.85 ALDH1A1 (0.51) ALDH1A1RAB9AHPGDKMT2APOLB
SCHEMBL21895676 0.85 ALDH1A1 (0.51) ALDH1A1RAB9AHPGDKMT2APOLB

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-20200115400-A1 METHOD FOR PRODUCING SILICON COMPOUND, AND SILICON COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 2020-04-16 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-20200115400-A1 METHOD FOR PRODUCING SILICON COMPOUND, AND SILICON COMPOUND SI, SIK1, CA1 ALDH1A1 881/4885RAB9A 3202/4885HPGD 893/4885

“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.