SCHEMBL20423604

SCHEMBL20423604

CC1(C)CCc2ccccc2C12CC2

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.53
ALDH1A1 P00352 1/20 0.45
TP53 P04637 1/20 0.45
MAOB P27338 1/20 0.44
SIGMAR1 Q99720 4/20 0.41
SRD5A1 P18405 1/20 0.41
TSHR P16473 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
HTR2A P28223 1/20 0.39
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL1574064 0.81 ALDH1A1 (0.46) KDM1AALDH1A1TP53MAOBSIGMAR1
SCHEMBL412891 0.76 KDM1A (0.48) KDM1AALDH1A1TP53MAOBTSHR
SCHEMBL27908726 0.76 KDM1A (0.48) KDM1AALDH1A1TP53MAOBTSHR
SCHEMBL29529565 0.76 KDM1A (0.48) KDM1AALDH1A1TP53MAOBTSHR
Ammonia Solution, Strong SCHEMBL27832849 0.74 KDM1A (0.47) KDM1AALDH1A1TP53MAOBTSHR
Hydrochloric Acid SCHEMBL27330764 0.74 KDM1A (0.47) KDM1AALDH1A1TP53MAOBSIGMAR1
SCHEMBL25068935 0.73 KDM1A (0.47) KDM1AMAOBTSHRTDP1HTR2A
Hydrochloric Acid SCHEMBL30124100 0.73 KDM1A (0.47) KDM1AALDH1A1TP53MAOBSIGMAR1
SCHEMBL2464182 0.72 KDM1A (0.55) KDM1AALDH1A1TP53MAOBSIGMAR1
SCHEMBL7441079 0.72 KDM1A (0.55) KDM1AALDH1A1TP53MAOBSIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230055376-A1 5-HT2C RECEPTOR AGONISTS AND COMPOSITIONS AND METHODS OF USE ARENA PHARMACEUTICALS, INC. 2023-02-23 US disclosed
EP-3328835-B1 5-HT2C RECEPTOR AGONISTS AND COMPOSITIONS AND METHODS OF USE ARENA PHARM INC (US) 2022-10-12 EP disclosed
US-11395824-B2 5-HT2C receptor agonists and compositions and methods of use ARENA PHARMACEUTICALS, INC. (US) 2022-07-26 US disclosed
US-20200383993-A1 5-HT2C RECEPTOR AGONISTS AND COMPOSITIONS AND METHODS OF USE ARENA PHARMACEUTICALS, INC. 2020-12-10 US disclosed
US-10624900-B2 5-HT2C receptor agonists and compositions and methods of use ARENA PHARMACEUTICALS, INC. (US) 2020-04-21 US disclosed
US-20200078368-A1 5-HT2C RECEPTOR AGONISTS AND COMPOSITIONS AND METHODS OF USE ARENA PHARMACEUTICALS, INC. 2020-03-12 US disclosed
US-10272094-B2 5-HT2C receptor agonists and compositions and methods of use ARENA PHARMACEUTICALS, INC. (US) 2019-04-30 US disclosed
US-20180214455-A1 5-HT2C RECEPTOR AGONISTS AND COMPOSITIONS AND METHODS OF USE ARENA PHARMACEUTICALS, INC. 2018-08-02 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 (7 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-10624900-B2 5-HT2C receptor agonists and compositions and methods of use HTR2C, HTR2A, HCRTR2 KDM1A 1318/4885ALDH1A1 1924/4885TP53 4860/4885
US-20180214455-A1 5-HT2C RECEPTOR AGONISTS AND COMPOSITIONS AND METHODS OF USE HTR2C, HTR2A, HCRTR2 KDM1A 1318/4885ALDH1A1 1924/4885TP53 4860/4885
US-20230055376-A1 5-HT2C RECEPTOR AGONISTS AND COMPOSITIONS AND METHODS OF USE HTR2C, HTR2A, HCRTR2 KDM1A 1318/4885ALDH1A1 1924/4885TP53 4860/4885
US-20200078368-A1 5-HT2C RECEPTOR AGONISTS AND COMPOSITIONS AND METHODS OF USE HTR2C, HTR2A, HCRTR2 KDM1A 1318/4885ALDH1A1 1924/4885TP53 4860/4885
US-10272094-B2 5-HT2C receptor agonists and compositions and methods of use HTR2C, HTR2A, HCRTR2 KDM1A 1318/4885ALDH1A1 1924/4885TP53 4860/4885
US-20200383993-A1 5-HT2C RECEPTOR AGONISTS AND COMPOSITIONS AND METHODS OF USE HTR2C, HTR2A, HCRTR2 KDM1A 1318/4885ALDH1A1 1924/4885TP53 4860/4885
US-11395824-B2 5-HT2C receptor agonists and compositions and methods of use HTR2C, HTR2A, HCRTR2 KDM1A 1318/4885ALDH1A1 1924/4885TP53 4860/4885

“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.