SCHEMBL16088712

SCHEMBL16088712

CC(=O)c1ccc(CNC(=O)c2ccccc2NS(C)(=O)=O)cc1

nearest known ligand 0.77

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 8/20 0.77
▸ ALDH1A1 P00352 7/20 0.77
▸ HSD17B10 Q99714 5/20 0.77
▸ HPGD P15428 4/20 0.77
▸ RCE1 Q9Y256 1/20 0.60
▸ SMN1; SMN2 Q16637 1/20 0.56
▸ PKM P14618 1/20 0.55
▸ TSHR P16473 3/20 0.53
▸ POLB P06746 1/20 0.53
▸ RECQL P46063 1/20 0.53
▸ KMT2A Q03164 2/20 0.51
▸ HTT P42858 1/20 0.51
▸ MEN1 O00255 1/20 0.49
▸ EPHX2 P34913 2/20 0.49
▸ NR1H4 Q96RI1 2/20 0.49
▸ MT-CO2 P00403 1/20 0.48

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
SCHEMBL16127952 0.90 ALDH1A1 (0.77) KDM4EALDH1A1HSD17B10HPGDRCE1
SCHEMBL16088690 0.78 APEX1 (0.79) KDM4EALDH1A1HPGDKMT2AHTT
SCHEMBL4580796 0.77 HDAC1 (0.71) —
SCHEMBL530857 0.76 KMT2A (0.68) KDM4EALDH1A1HSD17B10HPGDRCE1
SCHEMBL9624375 0.75 KMT2A (0.67) KDM4EALDH1A1HSD17B10HPGDRCE1
SCHEMBL1638701 0.74 ALDH1A1 (0.62) KDM4EALDH1A1HSD17B10HPGDRCE1
SCHEMBL27528618 0.74 KDM4E (0.57) KDM4EALDH1A1HSD17B10HPGDRCE1
SCHEMBL23375478 0.73 ALDH1A1 (0.65) KDM4EALDH1A1HSD17B10HPGDRCE1
SCHEMBL14458153 0.73 KCNA5 (0.67) KDM4EALDH1A1HSD17B10HPGDTSHR
SCHEMBL16127948 0.73 HPGD (0.66) KDM4EALDH1A1HSD17B10HPGDSMN1; SMN2

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-9452170-B2 Compounds and methods for inducing chondrogenesis THE CALIFORNIA INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2016-09-27 — — US disclosed
US-20160045514-A1 COMPOUNDS AND METHODS FOR INDUCING CHONDROGENESIS THE CALIFORNIA INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2016-02-18 — — US disclosed
US-20140271955-A1 COMPOUNDS AND METHODS FOR INDUCING CHONDROGENESIS THE SCRIPPS RESEARCH INSTITUTE (US) 2014-09-18 — — 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-20160045514-A1 COMPOUNDS AND METHODS FOR INDUCING CHONDROGENESIS COL2A1, BMP4, COL1A1 KDM4E 3497/4885ALDH1A1 52/4885HSD17B10 1408/4885
US-20140271955-A1 COMPOUNDS AND METHODS FOR INDUCING CHONDROGENESIS COL2A1, BMP4, COL1A1 KDM4E 3497/4885ALDH1A1 52/4885HSD17B10 1408/4885

“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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