SCHEMBL891151

SCHEMBL891151

Cc1cc(C2=C(c3cc(C)sc3C)CP(=O)(c3ccccc3)C2)c(C)s1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ ALDH1A1 P00352 3/20 0.35
▸ HTT P42858 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ PLA2G10 O15496 2/20 0.31
▸ HSD17B2 P37059 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ GAA P10253 1/20 0.30

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
SCHEMBL3423443 0.73 ALDH1A1 (0.44) KDM4ESMN1; SMN2ALDH1A1HTTNPSR1
SCHEMBL891066 0.71 HPGD (0.41) HPGDKDM4EALDH1A1MAPTTSHR
SCHEMBL11367086 0.70 HPGD (0.59) HPGDSMN1; SMN2MAPTTSHRLMNA
SCHEMBL12091657 0.65 ALDH1A1 (0.40) HPGDKDM4ESMN1; SMN2ALDH1A1TSHR
SCHEMBL7194664 0.65 ALDH1A1 (0.50) HPGDKDM4ESMN1; SMN2ALDH1A1HTT
SCHEMBL17340922 0.65 KDM4E (0.32) KDM4ESMN1; SMN2
SCHEMBL17340929 0.62 KDM4E (0.32) KDM4ESMN1; SMN2ALDH1A1
SCHEMBL13382629 0.61 ALDH1A1 (0.44) KDM4ESMN1; SMN2ALDH1A1MAPTPLA2G10
SCHEMBL19135544 0.61 ALDH1A1 (0.40) HPGDKDM4ESMN1; SMN2ALDH1A1HTT
SCHEMBL439365 0.61 HPGD (1.00) HPGDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8722076-B2 Photochrome- or near IR dye-coupled polymeric matrices for medical articles SURMODICS, INC. (US) 2014-05-13 — — US disclosed
US-20120082713-A1 PHOTOCHROME- OR NEAR IR DYE-COUPLED POLYMERIC MATRICES FOR MEDICAL ARTICLES BANK OF MONTREAL, AS COLLATERAL AGENT 2012-04-05 — — 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-20120082713-A1 PHOTOCHROME- OR NEAR IR DYE-COUPLED POLYMERIC MATRICES FOR MEDICAL ARTICLES IK, PIR, PLOD1 HPGD 1754/4885KDM4E 2503/4885SMN1; SMN2 2269/4885

“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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