SCHEMBL23701760

SCHEMBL23701760

O=C(O)Cc1c[nH]c2ccc(-c3cc4ccccc4s3)cc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.52
ALDH1A1 P00352 2/20 0.52
HPGD P15428 2/20 0.52
LMNA P02545 1/20 0.52
GLA P06280 1/20 0.52
CYP2C9 P11712 1/20 0.52
NFKB1 P19838 1/20 0.52
PMP22 Q01453 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
KDM4E B2RXH2 2/20 0.48
ICMT O60725 8/20 0.47
APP P05067 2/20 0.44
CNR2 P34972 1/20 0.43
ERN1 O75460 1/20 0.43
HDAC2 Q92769 1/20 0.42
SERPINE1 P05121 1/20 0.42
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL23701749 0.89 HPGD (0.53) ALDH1A1HPGDICMTAPPERN1
SCHEMBL23718992 0.87 ICMT (0.47) ALDH1A1LMNAKDM4EICMTAPP
SCHEMBL23701731 0.80 ALDH1A1 (0.59) TSHRALDH1A1HPGDLMNAGLA
Hydrochloric Acid SCHEMBL7305586 0.80 HTR1D (0.61) TSHRCYP2C9NFKB1PMP22NPSR1
SCHEMBL30261856 0.80 TSHR (0.66) TSHRALDH1A1HPGDLMNAGLA
SCHEMBL23701757 0.80 TSHR (0.66) TSHRALDH1A1HPGDLMNAGLA
SCHEMBL12537274 0.79 TLR2 (0.41) ALDH1A1LMNACYP2C9ICMTCNR2
SCHEMBL12562528 0.78 TLR2 (0.41) ALDH1A1LMNACYP2C9ICMTCNR2
SCHEMBL15331971 0.76 ERN1 (0.59) ALDH1A1APPERN1HDAC2HSD17B1
SCHEMBL23702342 0.73 ICMT (0.58) TSHRALDH1A1HPGDLMNAGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12150447-B2 Plant growth regulator UNIVERSITY OF WASHINGTON (US) 2024-11-26 US disclosed
US-20210235697-A1 PLANT GROWTH REGULATOR UNIVERSITY OF WASHINGTON (US) 2021-08-05 US disclosed
US-20210235697-A1 PLANT GROWTH REGULATOR UNIVERSITY OF WASHINGTON (US) 2021-08-05 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 (2 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-20210235697-A1 PLANT GROWTH REGULATOR ING2, GHRHR, MYB TSHR 57/4885ALDH1A1 3460/4885HPGD 3249/4885
US-12150447-B2 Plant growth regulator ING2, GHRHR, MYB TSHR 57/4885ALDH1A1 3460/4885HPGD 3249/4885

“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.