SCHEMBL18784684

SCHEMBL18784684

O=C(I)c1ccccc1C(=O)Nc1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.71
MEN1 O00255 6/20 0.67
KMT2A Q03164 6/20 0.67
TDP1 Q9NUW8 3/20 0.67
HPGD P15428 2/20 0.63
KDM4E B2RXH2 1/20 0.63
LMNA P02545 1/20 0.63
TP53 P04637 1/20 0.63
HTT P42858 1/20 0.63
HSD17B10 Q99714 1/20 0.63
METAP2 P50579 1/20 0.59
CYP3A4 P08684 1/20 0.59
CYP2C9 P11712 1/20 0.59
ALOX12 P18054 1/20 0.59
CHRNB2 P17787 1/20 0.59
CHRNB4 P30926 1/20 0.59
CHRNA3 P32297 1/20 0.59
CHRNA4 P43681 1/20 0.59
BCAT2 O15382 2/20 0.56
POLB P06746 1/20 0.56

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
SCHEMBL437231 0.89 ALDH1A1 (0.87) ALDH1A1MEN1KMT2ATDP1HPGD
SCHEMBL11266259 0.87 ALDH1A1 (0.83) ALDH1A1MEN1KMT2ATDP1HPGD
SCHEMBL11266257 0.87 ALDH1A1 (0.83) ALDH1A1MEN1KMT2ATDP1HPGD
SCHEMBL9853958 0.84 ALDH1A1 (0.71) ALDH1A1MEN1KMT2ATDP1HPGD
SCHEMBL1991348 0.83 ALDH1A1 (1.00) ALDH1A1MEN1KMT2ATDP1HPGD
SCHEMBL45299 0.83 ALDH1A1 (1.00) ALDH1A1MEN1KMT2ATDP1HPGD
Benodanil SCHEMBL18736 0.80 MEN1 (1.00) ALDH1A1MEN1KMT2ATDP1HPGD
SCHEMBL16634926 0.80 ALDH1A1 (0.71) ALDH1A1MEN1KMT2ATDP1HPGD
SCHEMBL1991352 0.80 ALDH1A1 (0.71) ALDH1A1MEN1KMT2ATDP1HPGD
SCHEMBL1203522 0.80 SMO (0.80) ALDH1A1MEN1KMT2ATDP1HPGD

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-10166237-B2 Compounds and methods for inducing chondrogenesis THE SCRIPPS RESEARCH INSTITUTE (US) 2019-01-01 US disclosed
US-20170112843-A1 COMPOUNDS AND METHODS FOR INDUCING CHONDROGENESIS THE SCRIPPS RESEARCH INSTITUTE 2017-04-27 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-10166237-B2 Compounds and methods for inducing chondrogenesis COL2A1, BMP4, BMP2 ALDH1A1 63/4885MEN1 4660/4885KMT2A 3000/4885
US-20170112843-A1 COMPOUNDS AND METHODS FOR INDUCING CHONDROGENESIS COL2A1, BMP4, BMP2 ALDH1A1 63/4885MEN1 4660/4885KMT2A 3000/4885

“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.