SCHEMBL18477663

SCHEMBL18477663

Cc1ccccc1C1C=CC=CC1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 5/20 0.38
ACHE P22303 2/20 0.38
TSHR P16473 1/20 0.38
DDB1 Q16531 1/20 0.36
CRBN Q96SW2 1/20 0.36
HTR2A P28223 3/20 0.35
HTR2B P41595 3/20 0.35
PBRM1 Q86U86 1/20 0.33
TNKS2 Q9H2K2 1/20 0.33
TAAR1 Q96RJ0 1/20 0.33
ALDH1A1 P00352 3/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
HRH3 Q9Y5N1 2/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 1/20 0.31
GSK3B P49841 1/20 0.31
BACE1 P56817 1/20 0.31

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
SCHEMBL24385162 0.86 HTR2C (0.41) HTR2CDDB1CRBNHTR2AHTR2B
SCHEMBL28239632 0.79 SMN1; SMN2 (0.38) HTR2CTSHRHTR2AHTR2BTNKS2
SCHEMBL22086312 0.79 CYP3A4 (0.35) TSHRALDH1A1MEN1KMT2A
SCHEMBL19417181 0.76 HTR2C (0.34) HTR2CACHETSHRDDB1CRBN
SCHEMBL24521923 0.75 TAAR1 (0.36) HTR2CACHETSHRDDB1CRBN
SCHEMBL28036409 0.75 CYP2C19 (0.42) HTR2CTSHRTAAR1MEN1KMT2A
SCHEMBL18656142 0.72 CYP3A4 (0.39) HTR2CHTR2AHTR2BTAAR1MEN1
SCHEMBL23430462 0.71 NCOA1 (0.36) HTR2CTAAR1ALDH1A1
SCHEMBL3429458 0.71 CYP11B2 (0.39) ALDH1A1MEN1KMT2A
SCHEMBL21279973 0.70 LDHA (0.46) ALDH1A1MEN1KMT2AGSK3B

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-20170038683-A1 COMPOUND, POLYMER COMPOUND, RESIST COMPOSITION, AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2017-02-09 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-20170038683-A1 COMPOUND, POLYMER COMPOUND, RESIST COMPOSITION, AND PATTERNING PROCESS WDR1, WDR26, LBR HTR2C 3147/4885ACHE 4866/4885TSHR 2544/4885

“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.